A systematic technique for the sequential restoration of salt structures

Science.gov (United States)

Rowan, Mark G.

1993-12-01

A method is described for the sequential restoration of cross sections in areas of salt tectonics where deformation is confined to the salt and higher layers. The subsurface geometry evolves with time through the interaction of various processes: sedimentation, compaction, isostatic adjustment, thermal subsidence (if present), faulting, and salt withdrawal/ diapirism. The technique systematically calculates and removes the effects of each of these processes during specified time intervals defined by the interpreted horizons. It makes no assumptions about salt kinematics and generally results in the area of the salt layer changing through time. The method is described for restoration of extensional terranes, but it is also suitable for areas of contractional salt tectonics with only minor modifications. After converting an interpreted seismic profile to depth, the top layer is stripped off and the underlying section is decompacted according to standard porosity-depth functions. A deep baseline, unaffected by compaction or deformation, is used to restore any isostatic compensation or thermal subsidence. Isostasy is calculated according to the Airy model, and differential sedimentary loading across a section is shown to be approximately balanced by changes in salt thickness so that the load is evenly distributed. After these processes have been reversed, the resulting geometry and the seismic data are used to create the sea-floor template for structural restoration. Fault offsets are removed and the layers down to the top salt are restored to this template, while the base salt remains fixed. The resulting space between the restored top salt and the fixed base salt defines the restored salt geometry. In addition, the difference between the sea-floor template and a fixed sea level provides a measure of the change in water depth (ignoring eustatic changes in sea level). The technique is applied to an interpreted seismic profile from the eastern Green Canyon/Ewing Bank

Structural and physicochemical characterization of pyridine derivative salts of anti-inflammatory drugs

Science.gov (United States)

Nechipadappu, Sunil Kumar; Trivedi, Darshak R.

2017-08-01

Salts of common anti-inflammatory drugs mefenamic acid (MFA), tolfenamic acid (TFA) and naproxen (NPX) with various pyridine derivatives (4-amino pyridine (4AP), 4-dimethylaminopyridine (DMAP) and 2-amino pyridine (2AP)) were synthesized by crystal engineering approach based on the pKa values of API's and the salt former. All the salts were characterized systematically by various spectroscopic methods including FT-IR and 1H NMR and the crystal structure was determined by single-crystal X-ray diffraction techniques (SCXRD). DMAP salt of NPX and 2AP salts of MFA and TFA were not obtained in the salt screening experiments. All the molecular salts exhibited 1:1 molecular stoichiometry in the asymmetric unit and except NPX-2AP salt, all the molecular salts included a water molecule in the crystal lattice. Physicochemical and structural properties between drug-drug molecular salts of MFA-4AP, TFA-4AP and NPX-4AP have been evaluated and it was found that these molecular salts were found to be stable for a time period of six months at ambient condition and further hydration of molecular salts were not observed even at accelerated humid conditions (∼75% RH). It was found that 4AP salts of MFA and TFA and DMAP salts of MFA and TFA are isostructural.

Structural testing of salt loaded HEPA filters for WIPP

International Nuclear Information System (INIS)

Smith, P.R.; Leslie, I.H.; Hensel, E.C.; Shultheis, T.M.; Walls, J.R.

1993-01-01

The ventilation studies of the Waste Isolation Pilot Plant described in this paper were performed by personnel from New Mexico State Univ. in collaboration with Sandia National Laboratories, Los Alamos National Laboratory and Westinghouse Corporation. High efficiency particulate air filters (0.61m by 0.61m by 0.3m) of the type in use at the Waste Isolation Pilot Plant were loaded with salt aerosol provided from that site. The structural strength of salt-loaded, high-efficiency filters was investigated at two humidity levels, high (75%RH) and low (13-14% RH), by subjecting the filters to pressure transients of the types expected from tornadoes. Filters loaded under the high humidity condition proved to have a greater structural strength than did the filters loaded under the low humidity conditions, when both types were subjected to tornado-like pressure pulses. This unexpected results was apparently due to the crystallization of salt upon the wire face guard of the HEPA filter loaded under the high humidity condition which kept salt from penetrating the filter medium while still providing a substantial pressure drop at the standard flow rate. Results are also presented for HEPA filters pre-conditioned at 100% RH before structural testing and for HEPA filters in series with pre-filters

Phase transformation of aluminium hydroxide to aα- alumina prepared from different aluminium salts

International Nuclear Information System (INIS)

Masliana Muslimin; Meor Yusoff Meor Sulaiman

2006-01-01

The study intends to look at the most suitable aluminium salt to produce a single-phase a-alumina by the hydrothermal method. In the process to produce alumina from the calcination of aluminium hydroxide (Al(OH) 3 ), three different aluminium salts namely aluminium sulfate (Al 2 (SO 4) 2), aluminium nitrate (A(NO 3 ) 3 ) and aluminium chloride (AlCl 3 ) were tried. The process involved the used of NH 4 OH as the precipitating medium. Aluminium hydroxide produced from each of these salts were characterised by x-ray diffraction (XRD) technique to identity the crystalline phase. Aluminium hydroxide produced by all the different aluminium salts is present as boehmite or pseudo-boehmite phase. Aluminium hydroxide produced from Al 2 (SO) 2 , Al(NO) 3 and AlCl 3 shows the transformation of the boehmite phase to a α-alumina phase at 500 0 C. On further heating, the α-alumina continuously formed at 800 o C followed soon at 1000 o C. But for the Al(NO3) 3 salts a different phase transitions occurs on heating especially at 1000 o C. Here it was observed not a single alumina phase is presence but the presence of both α and γ--alumina phases. At 1300 o C, the single α-alumina phase was formed. The study concluded that aluminium sulphate is recommended in order to obtain a single-phase α-alumina with the required characteristics. (Author)

Synthesis, growth, structural, optical and thermal properties of a new organic salt crystal: 3-nitroanilinium trichloroacetate

Science.gov (United States)

Selvakumar, E.; Chandramohan, A.; Anandha Babu, G.; Ramasamy, P.

2014-09-01

A new organic non-linear optical salt 3-nitroanilinium trichloroacetate has been synthesized and single crystals grown by slow solvent evaporation solution growth technique at room temperature using methanol as the solvent. The 1H and 13C Nuclear magnetic resonance spectra were recorded to establish the molecular structure of the title salt. The crystal structure of the title crystal has been determined by single crystal X-ray diffraction analysis and it belongs to monoclinic crystal system with non-centrosymmetric space group P21. Fourier transform infrared spectral study has been carried out to confirm the presence of various functional groups. The optical transmittance spectrum was recorded in the range 200-2500 nm, to find the optical transmittance window and lower cut off wavelength. The thermo gravimetric and differential thermal analyses were carried out to establish the thermal stability of the title crystal. The second harmonic generation in the title crystal was confirmed by the modified Kurtz-Perry powder test employing the Nd: YAG laser as the source for infrared radiation.

Effect of long-term changes in soil chemistry induced by road salt applications on N-transformations in roadside soils

International Nuclear Information System (INIS)

Green, Sophie M.; Machin, Robert; Cresser, Malcolm S.

2008-01-01

Of several impacts of road salting on roadside soils, the potential disruption of the nitrogen cycle has been largely ignored. Therefore the fates of low-level ammonium-N and nitrate-N inputs to roadside soils impacted by salting over an extended period (decades) in the field have been studied. The use of road salts disrupts the proportional contributions of nitrate-N and ammonium-N to the mineral inorganic fraction of roadside soils. It is highly probable that the degree of salt exposure of the soil, in the longer term, controls the rates of key microbial N transformation processes, primarily by increasing soil pH. Additional influxes of ammonium-N to salt-impacted soils are rapidly nitrified therefore and, thereafter, increased leaching of nitrate-N to the local waterways occurs, which has particular relevance to the Water Framework Directive. The results reported are important when assessing the fate of inputs of ammonia to soils from atmospheric pollution. - Road salting effects ammonification and nitrification in roadside soils

Effect of long-term changes in soil chemistry induced by road salt applications on N-transformations in roadside soils

Energy Technology Data Exchange (ETDEWEB)

Green, Sophie M. [Environment Department, University of York, Heslington, York Y010 5DD (United Kingdom)], E-mail: sg507@york.ac.uk; Machin, Robert; Cresser, Malcolm S. [Environment Department, University of York, Heslington, York Y010 5DD (United Kingdom)

2008-03-15

Of several impacts of road salting on roadside soils, the potential disruption of the nitrogen cycle has been largely ignored. Therefore the fates of low-level ammonium-N and nitrate-N inputs to roadside soils impacted by salting over an extended period (decades) in the field have been studied. The use of road salts disrupts the proportional contributions of nitrate-N and ammonium-N to the mineral inorganic fraction of roadside soils. It is highly probable that the degree of salt exposure of the soil, in the longer term, controls the rates of key microbial N transformation processes, primarily by increasing soil pH. Additional influxes of ammonium-N to salt-impacted soils are rapidly nitrified therefore and, thereafter, increased leaching of nitrate-N to the local waterways occurs, which has particular relevance to the Water Framework Directive. The results reported are important when assessing the fate of inputs of ammonia to soils from atmospheric pollution. - Road salting effects ammonification and nitrification in roadside soils.

Sea salt

OpenAIRE

Galvis-Sánchez, Andrea C.; Lopes, João Almeida; Delgadillo, Ivone; Rangel, António O. S. S.

2013-01-01

The geographical indication (GI) status links a product with the territory and with the biodiversity involved. Besides, the specific knowledge and cultural practices of a human group that permit transforming a resource into a useful good is protected under a GI designation. Traditional sea salt is a hand-harvested product originating exclusively from salt marshes from specific geographical regions. Once salt is harvested, no washing, artificial drying or addition of anti-caking agents are all...

Salt Damage and Rising Damp Treatment in Building Structures

Directory of Open Access Journals (Sweden)

J. M. P. Q. Delgado

2016-01-01

Full Text Available Salt damage can affect the service life of numerous building structures, both historical and contemporary, in a significant way. In this review, various damage mechanisms to porous building materials induced by salt action are analyzed. The importance of pretreatment investigations is discussed as well; in combination with the knowledge of salt and moisture transport mechanisms they can give useful indications regarding treatment options. The methods of salt damage treatment are assessed then, including both passive techniques based on environmental control, reduction of water transport, or conversion to less soluble salts and active procedures resulting in the removal of salts from deterioration zones. It is concluded that cellulose can still be considered as the favorite material presently used in desalination poultices but hydrophilic mineral wool can serve as its prospective alternative in future applications. Another important cause of building pathologies is the rising damp and, in this phenomenon, it is particularly severe considering the presence of salts in water. The treatment of rising damp in historic building walls is a very complex procedure and at Laboratory of Building Physics (LFC-FEUP a wall base hygroregulated ventilation system was developed and patented.

Structural, morphological and catalytic characterization of neutral Ag salt of 12-tungstophosphoric acid: Influence of preparation conditions

Energy Technology Data Exchange (ETDEWEB)

Holclajtner-Antunović, Ivanka; Bajuk-Bogdanović, Danica [Faculty of Physical Chemistry, University of Belgrade, Studentski trg 12-16, 11158 Belgrade (Serbia); Popa, Alexandru [Institute of Chemistry Timişoara, Bl. Mihail Viteazul 24, 300223 Timişoara (Romania); Nedić Vasiljević, Bojana [Faculty of Physical Chemistry, University of Belgrade, Studentski trg 12-16, 11158 Belgrade (Serbia); Krstić, Jugoslav [Institute of Chemistry, Technology and Metallurgy, University of Belgrade, Njegoševa 12, 11001 Belgrade (Serbia); Mentus, Slavko [Faculty of Physical Chemistry, University of Belgrade, Studentski trg 12-16, 11158 Belgrade (Serbia); Uskoković-Marković, Snežana, E-mail: snezaum@pharmacy.bg.ac.rs [Faculty of Pharmacy, University of Belgrade, Vojvode Stepe 450, 11221 Belgrade (Serbia)

2015-02-15

Graphical abstract: - Highlights: • Preparation conditions influence to self-assembly of nanocrystallites of Ag{sub 3}PW{sub 12}O{sub 40}. • Ag{sub 3}PW{sub 12}O{sub 40} obtained by filtration is microporous, Ag{sub 3}PW{sub 12}O{sub 40} obtained by evaporation is non-porous. • Thermal properties of Ag{sub 3}PW{sub 12}O{sub 40}, H{sub 3}PW{sub 12}O{sub 40} and its soluble salts are similar. - Abstract: The objective of this study is the structural and morphological characterization of the Ag{sub 3}PW{sub 12}O{sub 40} salts (AgWPA) of 12-tungstophosphoric acid (WPA) obtained under different preparation conditions and testing of their acid catalytic activity in dehydration of ethanol. The structure, morphology and physicochemical characteristics were determined by Fourier transform infrared (FT-IR) and Raman spectroscopy, X-ray diffraction (XRD), nitrogen physisorption at −196 °C, scanning electron microscopy (SEM) and differential thermal (DTA) and thermogravimetric analysis (TGA). It is shown that the preparation process has a significant influence on the morphological properties of the obtained materials which may be explained by the supposed mechanism of the formation of nanocrystallite′s aggregates with more or less epitaxial connection. Neutral AgWPA obtained by filtration from supernatant forms porous aggregates of a symmetric dodecahedral shape, having average sizes about 2 μm. This sample shows higher specific area in comparison with the salt obtained by evaporation due to the higher micropore volume, while mesopore volumes are the same for both salts. Thus conversion of ethanol and selectivities of the main products, ethylene and diethyl ether, are almost the same and constant for both prepared salts, while their values are changed over the reaction time for the parent WPA acid.

Mechanical structure and problem of thorium molten salt reactor

International Nuclear Information System (INIS)

Kamei, Takashi

2011-01-01

After Fukushima Daiichi accident, there became great interest in Thorium Molten Salt Reactor (MSR) for the safety as station blackout leading to auto drainage of molten salts with freeze valve. This article described mechanical structure of MSR and problems of materials and pipes. Material corrosion problem by molten salts would be solved using modified Hastelloy N with Ti and Nb added, which should be confirmed by operation of an experimental reactor. Trends in international activities of MSR were also referred including China declaring MSR development in January 2011 to solve thorium contamination issues at rare earth production and India rich in thorium resources. (T. Tanaka)

Phase transformation and magnetic properties of MnAl powders prepared by elemental-doping and salt-assisted ball milling

Science.gov (United States)

Qian, Hui-Dong; Si, Ping-Zhan; Choi, Chul-Jin; Park, Jihoon; Cho, Kyung Mox

2018-05-01

The effects of elemental doping of Si and Fe on the ɛ→τ phase transformation and the magnetic properties of MnAl were studied. The magnetic powders of Si- and Fe-doped MnAl were prepared by using induction melting followed by water-quenching, annealing, and salt-assisted ball-milling. The Fe-doped MnAl powders are mainly composed of the L10-structured τ-phase, while the Si-doped MnAl are composed of τ-phase and a small fraction of γ2- and β-phases. A unique thin leaves-like morphology with thickness of several tens of nanometers and diameter size up to 500 nm were observed in the Si-doped MnAl powders. The Fe-doped MnAl powders show irregular shape with much larger dimensions in the range from several to 10 μm. The morphology difference of the samples was ascribed to the variation of the mechanical properties affected by different doping elements. The phase transformation temperatures of the ɛ-phase of the samples were measured. The doping of Fe decreases the onset temperature of the massive phase transformation in MnAl, while the Si-doping increases the massive phase transformation temperature. Both Fe and Si increase the Curie temperature of MnAl. A substantially enhanced coercivity up to 0.45 T and 0.42 T were observed in the ball-milled MnAl powders doped with Si and Fe, respectively.

Ion diffusion related to structure in molten salts

International Nuclear Information System (INIS)

Tosi, M.P.

1996-08-01

A model first developed by Zwanzig to derive transport coefficients in cold dense fluids directly from the Green-Kubo time correlation formulae allows one to relate macroscopic diffusion coefficients to the local fluid structure. Applications to various ionic diffusion processes in molten salts are reviewed. Consequences of partial structural quenching are also discussed. (author). 28 refs, 3 tabs

Discrete Haar transform and protein structure.

Science.gov (United States)

Morosetti, S

1997-12-01

The discrete Haar transform of the sequence of the backbone dihedral angles (phi and psi) was performed over a set of X-ray protein structures of high resolution from the Brookhaven Protein Data Bank. Afterwards, the new dihedral angles were calculated by the inverse transform, using a growing number of Haar functions, from the lower to the higher degree. New structures were obtained using these dihedral angles, with standard values for bond lengths and angles, and with omega = 0 degree. The reconstructed structures were compared with the experimental ones, and analyzed by visual inspection and statistical analysis. When half of the Haar coefficients were used, all the reconstructed structures were not yet collapsed to a tertiary folding, but they showed yet realized most of the secondary motifs. These results indicate a substantial separation of structural information in the space of Haar transform, with the secondary structural information mainly present in the Haar coefficients of lower degrees, and the tertiary one present in the higher degree coefficients. Because of this separation, the representation of the folded structures in the space of Haar transform seems a promising candidate to encompass the problem of premature convergence in genetic algorithms.

Modeling internal deformation of salt structures targeted for radioactive waste disposal

International Nuclear Information System (INIS)

Chemia, Zurab

2008-01-01

This thesis uses results of systematic numerical models to argue that externally inactive salt structures, which are potential targets for radioactive waste disposal, might be internally active due to the presence of dense layers or blocks within a salt layer. The three papers that support this thesis use the Gorleben salt diapir (NW Germany), which was targeted as a future final repository for high-grade radioactive waste, as a general guideline. The first two papers present systematic studies of the parameters that control the development of a salt diapir and how it entrains a dense anhydrite layer. Results from these numerical models show that the entrainment of a dense anhydrite layer within a salt diapir depends on four parameters: sedimentation rate, viscosity of salt, perturbation width and the stratigraphic location of the dense layer. The combined effect of these four parameters, which has a direct impact on the rate of salt supply (volume/area of the salt that is supplied to the diapir with time), shape a diapir and the mode of entrainment. Salt diapirs down-built with sedimentary units of high viscosity can potentially grow with an embedded anhydrite layer and deplete their source layer (salt supply ceases). However, when salt supply decreases dramatically or ceases entirely, the entrained anhydrite layer/segments start to sink within the diapir. In inactive diapirs, sinking of the entrained anhydrite layer is inevitable and strongly depends on the rheology of the salt, which is in direct contact with the anhydrite layer. During the post-depositional stage, if the effective viscosity of salt falls below the threshold value of around 10 18 -10 19 Pa s, the mobility of anhydrite blocks might influence any repository within the diapir. However, the internal deformation of the salt diapir by the descending blocks decreases with increase in effective viscosity of salt. The results presented in this thesis suggest that it is highly likely that salt structures

Effects of basal media, salt concentrations, antioxidant supplements ...

African Journals Online (AJOL)

antioxidants than MS, LS and D basal media. Five different levels of N6 medium salts (10, 30, 50, 70 and 100%) were tested, and the highest transformation efficiency was 15.9% under a 50% salt concentration, followed by 6.4% transformation efficiency with 70 and 3.2% under 100% salt conditions. More than 95% of ...

Estimating Rheological Parameters of Anhydrite from Folded Evaporite sequences: Implications for Internal Dynamics of Salt Structure

Science.gov (United States)

Adamuszek, Marta; Dabrowski, Marcin; Schmalholz, Stefan M.; Urai, Janos L.; Raith, Alexander

2015-04-01

Salt structures have been identified as a potential target for hydrocarbon, CO2, or radioactive waste storage. The most suitable locations for magazines are considered in the thick and relatively homogeneous rock salt layers. However, salt structures often consist of the evaporite sequence including rock salt intercalated with other rock types e.g.: anhydrite, gypsum, potassium and magnesium salt, calcite, dolomite, or shale. The presence of such heterogeneities causes a serious disturbance in the structure management. Detailed analysis of the internal architecture and internal dynamics of the salt structure are crucial for evaluating them as suitable repositories and also their long-term stability. The goal of this study is to analyse the influence of the presence of anhydrite layers on the internal dynamics of salt structures. Anhydrite is a common rock in evaporite sequences. Its physical and mechanical properties strongly differ from the properties of rock salt. The density of anhydrite is much higher than the density of salt, thus anhydrite is likely to sink in salt causing the disturbance of the surrounding structures. This suggestion was the starting point to the discussion about the long-term stability of the magazines in salt structures [1]. However, the other important parameter that has to be taken into account is the viscosity of anhydrite. The high viscosity ratio between salt and anhydrite can restrain the layer from sinking. The rheological behaviour of anhydrite has been studied in laboratory experiments [2], but the results only provide information about the short-term behaviour. The long-term behaviour can be best predicted using indirect methods e.g. based on the analysis of natural structures that developed over geological time scale. One of the most promising are fold structures, the shape of which is very sensitive to the rheological parameters of the deforming materials. Folds can develop in mechanically stratified materials during layer

Total energy calculations for structural phase transformations

International Nuclear Information System (INIS)

Ye, Y.Y.; Chan, C.T.; Ho, K.M.; Harmon, B.N.

1990-01-01

The structural integrity and physical properties of crystalline solids are frequently limited or enhanced by the occurrence of phase transformations. Martensitic transformations involve the collective displacement of atoms from one ordered state to another. Modern methods to determine the microscopic electronic changes as the atoms move are now accurate enough to evaluate the very small energy differences involved. Extensive first principles calculations for the prototypical martensitic transformation from body-centered cubic (bcc) to closepacked 9R structure in sodium metal are described. The minimum energy coordinate or configuration path between the bcc and 9R structures is determined as well as paths to other competing close-packed structures. The energy barriers and important anharmonic interactions are identified and general conclusions drawn. The calculational methods used to solve the Schrodinger equation include pseudopotentials, fast Fourier transforms, efficient matrix diagnonalization, and supercells with many atoms

Impact on breeding rate of different Molten Salt reactor core structures

International Nuclear Information System (INIS)

Wang Haiwei; Mei Longwei; Cai Xiangzhou; Chen Jingen; Guo Wei; Jiang Dazhen

2013-01-01

Background: Molten Salt Reactor (MSR) has several advantages over the other Generation IV reactor. Referred to the French CNRS research and compared to the fast reactor, super epithermal neutron spectrum reactor type is slightly lower and beading rate reaches 1.002. Purpose: The aim is to explore the best conversion zone layout scheme in the super epithermal neutron spectrum reactor. This study can make nuclear fuel as one way to solve the energy problems of mankind in future. Methods: Firstly, SCALE program is used for molten salt reactor graphite channel, molten salt core structure, control rods, graphite reflector and layer cladding structure. And the SMART modules are used to record the important actinides isotopes and their related reaction values of each reaction channel. Secondly, the thorium-uranium conversion rate is calculated. Finally, the better molten salt reactor core optimum layout scheme is studied comparing with various beading rates. Results: Breading zone layout scheme has an important influence on the breading rate of MSR. Central graphite channels in the core can get higher neutron flux irradiation. And more 233 Th can convert to 233 Pa, which then undergoes beta decay to become 233 U. The graphite in the breading zone gets much lower neutron flux irradiation, so the life span of this graphite can be much longer than that of others. Because neutron flux irradiation in the uranium molten salt graphite has nearly 10 times higher than the graphite in the breading zone, it has great impact on the thorium-uranium conversion rates. For the super epithermal neutron spectrum molten salt reactors, double salt design cannot get higher thorium-uranium conversion rates. The single molten salt can get the same thorium-uranium conversion rate, meanwhile it can greatly extend the life of graphite in the core. Conclusions: From the analysis of calculation results, Blanket breeding area in different locations in the core can change the breeding rates of thorium

Fourier transform near-infrared spectroscopy application for sea salt quality evaluation.

Science.gov (United States)

Galvis-Sánchez, Andrea C; Lopes, João Almeida; Delgadillo, Ivonne; Rangel, António O S S

2011-10-26

Near-infrared (NIR) spectroscopy in diffuse reflectance mode was explored with the objective of discriminating sea salts according to their quality type (traditional salt vs "flower of salt") and geographical origin (Atlantic vs Mediterranean). Sea salts were also analyzed in terms of Ca(2+), Mg(2+), K(+), alkalinity, and sulfate concentrations to support spectroscopic results. High concentrations of Mg(2+) and K(+) characterized Atlantic samples, while a high Ca(2+) content was observed in traditional sea salts. A partial least-squares discriminant analysis model considering the 8500-7500 cm(-1) region permitted the discrimination of salts by quality types. The regions 4650-4350 and 5900-5500 cm(-1) allowed salts classification according to their geographical origin. It was possible to classify correctly 85.3 and 94.8% of the analyzed samples according to the salt type and to the geographical origin, respectively. These results demonstrated that NIR spectroscopy is a suitable and very efficient tool for sea salt quality evaluation.

Morphology and anatomical structure of the larval salt gland of ...

African Journals Online (AJOL)

Ezedom Theresa

2013-10-09

Oct 9, 2013 ... the morphology and fine structure of the ion transporting epithelium ... The general structure of the salt gland of nauplii cultured at 180 g/L disappeared. ...... Wu G, Zhang H, Sun J, Liu F, Ge X, Chen WH, Yu, J, Wang W (2011).

Salt effect on physiological, biochemical and anatomical structures ...

African Journals Online (AJOL)

In this study, we evaluated the salt concentration effect on plant growth, mineral composition, antioxidant responses and anatomical structure of two varieties of Origanum majorana after exposure to NaCl treatment. Our results show an inclusive behaviour of the two varieties, since the majority of sodium was exported and ...

A study on the structure of thorium salt solutions

International Nuclear Information System (INIS)

Magini, M.; Cabrini, A.; Di Bartolomeo, A.

1975-01-01

The structure of highly hydrolyzed thorium salt solutions has been investigated by large and small angle X-ray scattering techniques. The diffraction data obtained with large angle measurements show the presence in solution of microcrystalline particles with the thorium oxide structure. Particles larger than those were discovered by small angle measurements. A possible shape of these colloidal particles has been discussed

Mitochondrial membranes with mono- and divalent salt: changes induced by salt ions on structure and dynamics

DEFF Research Database (Denmark)

Pöyry, Sanja; Róg, Tomasz; Karttunen, Mikko

2009-01-01

We employ atomistic simulations to consider how mono- (NaCl) and divalent (CaCl(2)) salt affects properties of inner and outer membranes of mitochondria. We find that the influence of salt on structural properties is rather minute, only weakly affecting lipid packing, conformational ordering......, and membrane electrostatic potential. The changes induced by salt are more prominent in dynamical properties related to ion binding and formation of ion-lipid complexes and lipid aggregates, as rotational diffusion of lipids is slowed down by ions, especially in the case of CaCl(2). In the same spirit, lateral...... diffusion of lipids is slowed down rather considerably for increasing concentration of CaCl(2). Both findings for dynamic properties can be traced to the binding of ions with lipid head groups and the related changes in interaction patterns in the headgroup region, where the binding of Na(+) and Ca(2+) ions...

The structure of salt marsh soil mesofauna food webs - The prevalence of disturbance.

Science.gov (United States)

Haynert, Kristin; Kiggen, Mirijam; Klarner, Bernhard; Maraun, Mark; Scheu, Stefan

2017-01-01

Mesofauna taxa fill key trophic positions in soil food webs, even in terrestrial-marine boundary habitats characterized by frequent natural disturbances. Salt marshes represent such boundary habitats, characterized by frequent inundations increasing from the terrestrial upper to the marine pioneer zone. Despite the high abundance of soil mesofauna in salt marshes and their important function by facilitating energy and carbon flows, the structure, trophic ecology and habitat-related diet shifts of mesofauna species in natural salt marsh habitats is virtually unknown. Therefore, we investigated the effects of natural disturbance (inundation frequency) on community structure, food web complexity and resource use of soil mesofauna using stable isotope analysis (15N, 13C) in three salt marsh zones. In this intertidal habitat, the pioneer zone is exposed to inundations twice a day, but lower and upper salt marshes are less frequently inundated based on shore height. The mesofauna comprised 86 species / taxa dominated by Collembola, Oribatida and Mesostigmata. Shifts in environmental disturbances influenced the structure of food webs, diversity and density declined strongly from the land to the sea pointing to the importance of increasing levels of inundation frequency. Accordingly, the reduced diversity and density was associated by a simplification of the food web in the pioneer zone as compared to the less inundated lower and upper salt marsh with a higher number of trophic levels. Strong variations in δ15N signatures demonstrated that mesofauna species are feeding at multiple trophic levels. Primary decomposers were low and most mesofauna species functioned as secondary decomposers or predators including second order predators or scavengers. The results document that major decomposer taxa, such as Collembola and Oribatida, are more diverse than previously assumed and predominantly dwell on autochthonous resources of the respective salt marsh zone. The results further

Characterization of the molten salt reactor experiment fuel and flush salts

International Nuclear Information System (INIS)

Williams, D.F.; Peretz, F.J.

1996-01-01

Wise decisions about the handling and disposition of spent fuel from the Molten Salt Reactor Experiment (MSRE) must be based upon an understanding of the physical, chemical, and radiological properties of the frozen fuel and flush salts. These open-quotes staticclose quotes properties can be inferred from the extensive documentation of process history maintained during reactor operation and the knowledge gained in laboratory development studies. Just as important as the description of the salt itself is an understanding of the dynamic processes which continue to transform the salt composition and govern its present and potential physicochemical behavior. A complete characterization must include a phenomenological characterization in addition to the typical summary of properties. This paper reports on the current state of characterization of the fuel and flush salts needed to support waste management decisions

Structural transition in aqueous lipid/bile salt [DPPC/NaDC] supramolecular aggregates: SANS and DLS study

International Nuclear Information System (INIS)

Kiselev, M.A.; Janich, M.; Hildebrand, A.; Strunz, P.; Neubert, R.H.H.; Lombardo, D.

2013-01-01

Highlights: • Self-assembly in model DPPC lipids and NaDC bile salt by SANS and DLS experiments. • Bile salt creates structural interference against cohesive tendency of DPPC bilayers. • NaDC steric interactions cause transition toward different supramolecular structures. - Abstract: Small angle neutron scattering (SANS) and dynamic light scattering (DLS) were used to study different aggregation states in sodium deoxycholate (NaDC)-phosphatidylcholine systems at T = 60 °C. Size and shape of the aggregates investigated as a function of the NaDC bile salt concentration (at the constant DPPC concentration of 6 mM) indicate a strong dependence of the size and morphology of the generated aggregates on the relative amount of NaDC bile salt. More specifically large occupied area of the bile salt induces a steric interaction which promotes the transition toward a variety of supramolecular structures ranging from ellipsoidal vesicles, ribbon-like structures, up to final spherical mixed micelles at the large amount of bile salt of 10 mM NaDC. The findings of the obtained results give important insight for understanding the formation of different topologies in aqueous lipid–bile salt mixtures as well as stimulate new routes for liposome reconstitution–solubilisation processes suitable for technological applications

Co-transforming bar and CsALDH Genes Enhanced Resistance to Herbicide and Drought and Salt Stress in Transgenic Alfalfa (Medicago sativa L.)

Science.gov (United States)

Duan, Zhen; Zhang, Daiyu; Zhang, Jianquan; Di, Hongyan; Wu, Fan; Hu, Xiaowen; Meng, Xuanchen; Luo, Kai; Zhang, Jiyu; Wang, Yanrong

2015-01-01

Drought and high salinity are two major abiotic factors that restrict the productivity of alfalfa. By application of the Agrobacterium-mediated transformation method, an oxidative responsive gene, CsALDH12A1, from the desert grass Cleistogenes songorica together with the bar gene associated with herbicide resistance, were co-transformed into alfalfa (Medicago sativa L.). From the all 90 transformants, 16 were positive as screened by spraying 1 mL L-1 10% Basta solution and molecularly diagnosis using PCR. Real-time PCR analysis indicated that drought and salt stress induced high CsALDH expression in the leaves of the transgenic plants. The CsALDH expression levels under drought (15 d) and salt stress (200 mM NaCl) were 6.11 and 6.87 times higher than in the control plants, respectively. In comparison to the WT plants, no abnormal phenotypes were observed among the transgenic plants, which showed significant enhancement of tolerance to 15 d of drought and 10 d of salinity treatment. Evaluation of the physiological and biochemical indices during drought and salt stress of the transgenic plants revealed relatively lower Na+ content and higher K+ content in the leaves relative to the WT plants, a reduction of toxic on effects and maintenance of osmotic adjustment. In addition, the transgenic plants could maintain a higher relative water content level, higher shoot biomass, fewer changes in the photosystem, decreased membrane injury, and a lower level of osmotic stress. These results indicate that the co-expression of the introduced bar and CsALDH genes enhanced the herbicide, drought and salt tolerance of alfalfa and therefore can potentially be used as a novel genetic resource for the future breeding programs to develop new cultivars. PMID:26734025

Magnetic coupling at perovskite and rock-salt structured interfaces

Energy Technology Data Exchange (ETDEWEB)

Matvejeff, M., E-mail: mikko.matvejeff@picosun.com [Institute for Solid State Physics, University of Tokyo, 5-1-5 Kashiwanoha, Kashiwa, 277-8581 Chiba (Japan); Department of Chemistry, Aalto University, Kemistintie 1, 02150 Espoo (Finland); Ahvenniemi, E. [Department of Chemistry, Aalto University, Kemistintie 1, 02150 Espoo (Finland); Takahashi, R.; Lippmaa, M. [Institute for Solid State Physics, University of Tokyo, 5-1-5 Kashiwanoha, Kashiwa, 277-8581 Chiba (Japan)

2015-10-05

We study magnetic coupling between hole-doped manganite layers separated by either a perovskite or a rock-salt barrier of variable thickness. Both the type and the quality of the interface have a strong impact on the minimum critical barrier thickness where the manganite layers become magnetically decoupled. A rock-salt barrier layer only 1 unit cell (0.5 nm) thick remains insulating and is able to magnetically de-couple the electrode layers. The technique can therefore be used for developing high-performance planar oxide electronic devices such as magnetic tunnel junctions and quantum well structures that depend on magnetically and electronically sharp heterointerfaces.

Removal of amino groups from anilines through diazonium salt-based reactions.

Science.gov (United States)

He, Linman; Qiu, Guanyinsheng; Gao, Yueqiu; Wu, Jie

2014-09-28

This minireview describes the applications of in situ generated diazonium salts from anilines in organic synthesis. In situ generation of diazonium salts from anilines represents an efficient and practical pathway, leading to a series of useful structures. In these transformations, the amino group of aniline formally acts as a leaving group. Two distinctive kinds of mechanisms, including transition metal (especially palladium)-catalyzed oxidative addition-reductive elimination and a radical process, are involved in the removal of amino groups from anilines, and both catalytic processes are described in this minireview.

Topotactic transformations of sodalite cages: synthesis and NMR study of mixed salt-free and salt-bearing sodalites.

Science.gov (United States)

Trill, Henning; Eckert, Hellmut; Srdanov, Vojislav I

2002-07-17

A series of mixed sodalite samples, Na(8)[Al(6)Si(6)O(24)]Br(x).(H(3)O(2))(2-x), with the unit cell stoichiometries varying in the 0 < x <2 region, was made by hydrothermal synthesis and subsequently transformed into Na(6+x)[Al(6)Si(6)O(24)]Br(x).(4H(2)O)(2-x) and Na(6+x)[Al(6)Si(6)O(24)]Br(x).circle(2-x) sodalites. Here, circle refers to an empty sodalite cage. The three series, referred hereafter to as the Br/basic, Br/hydro, and Br/dry series, were characterized by powder diffraction X-ray and by (23)Na, (27)Al, and (81)Br magic angle spinning (MAS) NMR and high-resolution triple quantum (TQ) MAS NMR spectroscopy. We determined that incorporation of Br(-) anions is 130 times more preferred than incorporation of H(3)O(2)(-) anions during the formation of sodalite cages, which permitted precise control of the halide content in the solid. Monotonic trends in chemical shifts were observed as a function of cage occupancy, reflecting continuous changes in structural parameters. A linear correlation between (81)Br chemical shift and lattice constant with a slope of -86 ppm/A was observed for all three series. Likewise, (23)Na chemical shifts for Na(+) cations in salt-bearing sodalite cages correlate linearly with the lattice constant. Both results indicate a universal dependence of the (23)Na and (81)Br chemical shifts on the Na-Br distance. The (27)Al chemical shifts of Br/basic and Br/hydro sodalites obey an established relation between delta(cs) and the average T-O-T bond angle of 0.72 ppm/degrees. Br/dry sodalites show two aluminum resonances, characterized by significantly different chemical shifts and quadrupolar interaction parameters. In that series, local symmetry distortions are evident from strong quadrupolar perturbations in the NMR spectra. P(Q) values for (27)Al vary between 0.8 MHz in Br/basic sodalites and 4.4 MHz in the Br/dry series caused by deviations from the tetrahedral symmetry of the salt-free sodalite cages. For (23)Na, P(Q) values of 0.8, 0

Fuel salt and container material studies for MOSART transforming system

Energy Technology Data Exchange (ETDEWEB)

Ignatiev, V.; Feynberg, O.; Merzlyakov, A.; Surenkov, A.; Zagnitko, A. [National Research Center, Kurchatov Institute, Moscow (Russian Federation); Afonichkin, V.; Bovet, A.; Khokhlov, V. [Institute of High Temperature Electrochemisty, Ekaterinburg (Russian Federation); Subbotin, V.; Gordeev, M.; Panov, A.; Toropov, A. [Institute of Technical Physics, Snezhinsk (Russian Federation)

2013-07-01

A study is under progress to examine the feasibility of single stream Molten Salt Actinide Recycling and Transmuting system without and with Th support (MOSART) fuelled with different compositions of actinide tri-fluorides (AnF{sub 3}) from used LWR fuel. New fast-spectrum design options with homogeneous core and fuel salts with high enough solubility for AnF{sub 3} are being examined because of new goals. The flexibility of single fluid MOSART concept with Th support is underlined, particularly, possibility of its operation in self-sustainable mode (Conversion Ratio: CR=1) using different loadings and make up. The paper summarizes the most current status of fuel salt and container material data for the MOSART concept received within ISTC-3749 and ROSATOM-MARS projects. Key physical and chemical properties of various fluoride fuel salts are reported. The issues like salt purification, the electroreduction of U(IV) to U(III) in LiF-ThF{sub 4} and the electroreduction of Yb(III) to Yb(II) in LiF-NaF are detailed.

Formation of an Anti-Core–Shell Structure in Layered Oxide Cathodes for Li-Ion Batteries

Energy Technology Data Exchange (ETDEWEB)

Zhang, Hanlei [Materials; amp, Department; NorthEast; Omenya, Fredrick [NorthEast; Whittingham, M. Stanley [NorthEast; Wang, Chongmin [Environmental; Zhou, Guangwen [Materials; amp, Department; NorthEast

2017-10-20

The layered → rock-salt phase transformation in the layered dioxide cathodes for Li-ion batteries is believed to result in a “core-shell” structure of the primary particles, in which the core region maintains as the layered phase while the surface region undergoes the phase transformation to the rock-salt phase. Using transmission electron microscopy, here we demonstrate the formation of an “anti-core-shell” structure in cycled primary particles with a formula of LiNi0.80Co0.15Al0.05O2, in which the surface and subsurface regions remain as the layered structure while the rock-salt phase forms as domains in the bulk with a thin layer of the spinel phase between the rock-salt core and the skin of the layered phase. Formation of this anti-core-shell structure is attributed to the oxygen loss at the surface that drives the migration of oxygen from the bulk to the surface, thereby resulting in localized areas of significantly reduced oxygen levels in the bulk of the particle, which subsequently undergoes the phase transformation to the rock-salt domains. The formation of the anti-core-shell rock-salt domains is responsible for the reduced capacity, discharge voltage and ionic conductivity in cycled cathode.

Novel ordered structures in the mixture of water/organic solvent/salts investigated by neutron scattering

International Nuclear Information System (INIS)

Sadakane, Koichiro

2013-01-01

The effect of an antagonistic salt on the phase behavior and nanoscale structure of a mixture of water/organic solvent was investigated by visual inspection, optical microscope, and small-angle neutron scattering (SANS). The addition of the antagonistic salt, namely sodium tetraphenylborate (NaBPh 4 ), induces the shrinking of the two-phase region in contrast to the case in which a normal (hydrophilic) salt is added. Below the phase separation point, the SANS profiles cannot be described by the Ornstein-Zernike function owing to the existence of a long-range periodic structure. With increasing salt concentration, the critical exponents change from the values of 3D-Ising and approach those of 2D-Ising. Furthermore, an ordered phase with multilamellar (onion) structures was confirmed in an off-critical mixture of D 2 O and 3-methylpyridine containing 85 mM of a NaBPh 4 although no surfactants or polymers are contained. (author)

Two Voriconazole salts: Syntheses, crystal structures, solubility and bioactivities

Science.gov (United States)

Tang, Gui-Mei; Wang, Yong-Tao

2018-01-01

Two Voriconazole salts, namely, (H2FZ)2+·2(Cl-) (1) and (HFZ)+·NO3- (2) (FZ = (2R,3S)-2-(2,4-difluorophenyl)-3-(5-fluoro-4-pyrimidiny)-1-(1H-1,2,4-triazol-1-yl)-2-butanol) have been obtained through the reaction of Voriconazole, hydrochloric acid and nitrate acid, respectively. They were structurally characterized by FT-IR, elemental analyses (EA), single crystal X-ray diffraction, and thermogravimetric analysis (TGA). A variety of hydrogen bonds (Osbnd H⋯N, Nsbnd H⋯Cl/O, Csbnd H⋯N/OF/Cl) were observed in the compounds 1 and 2, through which a 3D supramolecular architecture is generated. Both two salts 1 and 2 show the promising bioactivities against Aspergillus species (Aspergillus niger, Aspergillus terreus, Aspergillus fumigatus and Aspergillus flavus) and Candida ones (Candida albicans, Candida krusei, Candida glabrata and Cryptococcus neoformans), which is obviously more excellent than that of FZ. Additionally, the solubility of two salts is considerably higher than that of the drug Voriconazole.

Balancing sub- and supra-salt strain in salt-influenced rifts: Implications for extension estimates

Science.gov (United States)

Coleman, Alexander J.; Jackson, Christopher A.-L.; Duffy, Oliver B.

2017-09-01

The structural style of salt-influenced rifts may differ from those formed in predominantly brittle crust. Salt can decouple sub- and supra-salt strain, causing sub-salt faults to be geometrically decoupled from, but kinematically coupled to and responsible for, supra-salt forced folding. Salt-influenced rifts thus contain more folds than their brittle counterparts, an observation often ignored in extension estimates. Fundamental to determining whether sub- and supra-salt structures are kinematically coherent, and the relative contributions of thin- (i.e. gravity-driven) and thick-skinned (i.e. whole-plate stretching) deformation to accommodating rift-related strain, is our ability to measure extension at both structural levels. We here use published physical models of salt-influenced extension to show that line-length estimates yield more accurate values of sub- and supra-salt extension compared to fault-heave, before applying these methods to seismic data from the Halten Terrace, offshore Norway. We show that, given the abundance of ductile deformation in salt-influenced rifts, significant amounts of extension may be ignored, leading to the erroneous interpretations of thin-skinned, gravity-gliding. If a system is kinematically coherent, supra-salt structures can help predict the occurrence and kinematics of sub-salt faults that may be poorly imaged and otherwise poorly constrained.

Effect of basement structure and salt tectonics on deformation styles along strike: An example from the Kuqa fold-thrust belt, West China

Science.gov (United States)

Neng, Yuan; Xie, Huiwen; Yin, Hongwei; Li, Yong; Wang, Wei

2018-04-01

The Kuqa fold-thrust belt (KFTB) has a complex thrust-system geometry and comprises basement-involved thrusts, décollement thrusts, triangle zones, strike-slip faults, transpressional faults, and pop-up structures. These structures, combined with the effects of Paleogene salt tectonics and Paleozoic basement uplift form a complex structural zone trending E-W. Interpretation and comprehensive analysis of recent high-quality seismic data, field observations, boreholes, and gravity data covering the KFTB has been performed to understand the characteristics and mechanisms of the deformation styles along strike. Regional sections, fold-thrust system maps of the surface and the sub-salt layer, salt and basement structure distribution maps have been created, and a comprehensive analysis of thrust systems performed. The results indicate that the thrust-fold system in Paleogene salt range can be divided into five segments from east to west: the Kela-3, Keshen, Dabei, Bozi, and Awate segments. In the easternmost and westernmost parts of the Paleogene salt range, strike-slip faulting and basement-involved thrusting are the dominant deformation styles, as basement uplift and the limits of the Cenozoic evaporite deposit are the main controls on deformation. Salt-core detachment fold-thrust systems coincide with areas of salt tectonics, and pop-up, imbricate, and duplex structures are associated with the main thrust faults in the sub-salt layer. Distribution maps of thrust systems, basement structures, and salt tectonics show that Paleozoic basement uplift controlled the Paleozoic foreland basin morphology and the distribution of Cenozoic salt in the KFTB, and thus had a strong influence on the segmented structural deformation and evolution of the fold-thrust belt. Three types of transfer zone are identified, based on the characteristics of the salt layer and basement uplift, and the effects of these zones on the fault systems are evaluated. Basement uplift and the boundary of

Structural transformations of carbon chains inside nanotubes

International Nuclear Information System (INIS)

Warner, Jamie H.; Ruemmeli, Mark H.; Bachmatiuk, Alicja; Buechner, Bernd

2010-01-01

In situ aberration-corrected high-resolution transmission electron microscopy is used to examine the structural transformations of carbon chains that occur in the interior region of carbon nanotubes. We find electron-beam irradiation leads to the formation of two-dimensional carbon structures that are freely mobile inside the nanotube. The inner diameter of the nanotube influences the structural transformations of the carbon chains. As the diameter of the nanotube increases, electron-beam irradiation leads to curling of the chains and eventually the formation of closed looped structures. The closed looped structures evolve into spherical fullerenelike structures that exhibit translational motion inside the nanotubes and also coalesce to form larger nanotube structures. These results demonstrate the use of carbon nanotubes as test tubes for growing small carbon nanotubes within the interior by using only electron-beam irradiation at 80 kV.

Relationship between mechanical properties and crystal structure in cocrystals and salt of paracetamol.

Science.gov (United States)

Ahmed, Hamzah; Shimpi, Manishkumar R; Velaga, Sitaram P

2017-01-01

Objectives were to study mechanical properties of various solid forms of paracetamol and relate to their crystal structures. Paracetamol form I (PRA), its cocrystals with oxalic acid (PRA-OXA) and 4,4-bipyridine (PRA-BPY) and hydrochloride salt (PRA-HCL) were selected. Cocrystals and salt were scaled-up using rational crystallization methods. The resulting materials were subjected to different solid-state characterizations. The powders were sieved and 90-360 µm sieve fraction was considered. These powders were examined by scanning electron microscopy (SEM) and densities were determined. Tablets were made at applied pressures of 35-180 MPa under controlled conditions and the tablet height, diameter and hardness were measured. Tensile strength and porosity of the tablets were estimated using well known models. Crystal structures of these systems were visualized and slip planes were identified. Cocrystal and salt of PRA were physically pure. Sieved powders had comparable morphologies and particle size. The apparent and theoretical densities of powders were similar, but no clear trends were observed. The tensile strengths of these compacts were increased with increasing pressure whereas tabletability decreased in the order oxalic acid > PRA-HCL ≈ PRA-OXA > BPY > PRA-BPY. Tablet tensile strength decreases exponentially with increasing porosity with the exception of PRY-BPY and BPY. Slip plane prediction based on attachment energies may not be independently considered. However, it was possible to explain the improved mechanical properties of powders based on the crystal structure. Cocrystallization and salt formation have introduced structural features that are responsible for improved tableting properties of PRA.

Structure, Ion Transport, and Rheology of Nanoparticle Salts

KAUST Repository

Wen, Yu Ho

2014-07-08

Above a critical surface chemistry-dependent particle loading associated with nanoscale interparticle spacing, ligand-ligand interactions-both electrostatic and steric-come into play and govern the structure and dynamics of charged oligomer-functionalized nanoparticle suspensions. We report in particular on the structure, ion transport, and rheology of suspensions of nanoparticle salts created by cofunctionalization of silica particles with tethered sulfonate salts and oligomers. Dispersion of the hairy ionic particles into medium and high dielectric constant liquids yields electrolytes with unique structure and transport properties. We find that electrostatic repulsion imparted by ion dissociation can be tuned to control the dispersion state and rheology through counterion size (i.e., Li+, Na+, and K+) and dielectric properties of the dispersing medium. Analysis of small-angle X-ray scattering (SAXS) structure factors and the mechanical modulus shows that when the interparticle spacing approaches nanometer dimensions, weakly entangled anchored ligands experience strong and long-lived topological constraints analogous to those normally found in well-entangled polymeric fluids. This finding provides insight into the molecular origins of the surprisingly similar rubbery plateau moduli observed in hairy nanoparticle suspensions and entangled polymers of the same chemistry as the tethered ligands. Additionally, we find that a time-composition superposition (TCS) principle exists for the suspensions, which can be used to substantially extend the observation time over which dynamics are observed in jammed, soft glassy suspensions. Application of TCS reveals dynamical similarities between the suspensions and entangled solutions of linear polymer chains; i.e., a hairy particle trapped in a cage appears to exhibit analogous dynamics to a long polymer chain confined to a tube. © 2014 American Chemical Society.

Deconstructing the BRICs : Structural transformation and aggregate productivity growth

NARCIS (Netherlands)

de Vries, G.J.; Erumban, Abdul Azeez; Timmer, M.P.; Voskoboynikov, I.; Wu, H.X.

de Vries, Gaaitzen J., Erumban, Abdul A., Timmer, Marcel P., Voskoboynikov, Ilya-Deconstructing the BRICs: Structural transformation and aggregate productivity growth This paper studies structural transformation and its implications for productivity growth in the BRIC countries (Brazil, Russia,

Structural, micro-structural and kinematic analyses of channel flow in the Karmostaj salt diapir in the Zagros foreland folded belt, Fars province, Iran

Science.gov (United States)

Sarkarinejad, Khalil; Sarshar, Maryam Asadi; Adineh, Sadegh

2018-02-01

One of the main characteristic of the Zagros foreland fold-and-thrust belt and the Zagros foreland folded belt are wide distributions of surface extrusion from the Hormuz salt diapirs. This study examines the structure and kinematic of channel flow in the Karmostaj salt diapir in the southwestern part of the Zagros foreland folded belt. This diapir has reached the surface as a result of the channel flow mechanism and has extruded in the southern limb of the Kuh-Gach anticline which is an asymmetric décollement fold with convergence to the south. Structural and microstructural studies and quantitative finite strain (Rs) and kinematic vorticity number (Wk) analyses were carried out within this salt diapir and its namakier. This was in order to investigate the structural evolution in the salt diapiric system, the characteristics and mechanism of the salt flow and the distribution of flow regimes within the salt diapir and interaction of regional tectonics and salt diaprism. The extruded salt has developed a flow foliation sub-parallel to the remnant bedding recorded by different colors, a variety of internal folds including symmetrical and asymmetrical folds and interference fold patterns, shear zones, and boudins. These structures were used to analyze mechanisms and history of diapiric flow and extrusion. The microstructures, reveal various deformation mechanisms in various parts of salt diapir. The measurements of finite strain show that Rs values in the margin of salt diapir are higher than within its namakier which is consistent with the results of structural studies. Mean kinematic vorticity number (Wm) measured in steady state deformation of diapir and namakier is Wm = 0.45-0.48 ± 0.13. The estimated mean finite deformation (Wm) values indicate that 67.8% pure shear and 32.2% simple shear deformation were involved; the implications of which are discussed. The vorticity of flow indicates that in the early stage of growth, Poiseuille flow was the dominate

Structure preserving transformations for Newtonian Lie-admissible equations

International Nuclear Information System (INIS)

Cantrijn, F.

1979-01-01

Recently, a new formulation of non-conservative mechanics has been presented in terms of Hamilton-admissible equations which constitute a generalization of the conventional Hamilton equations. The algebraic structure entering the Hamilton-admissible description of a non-conservative system is that of a Lie-admissible algebra. The corresponding geometrical treatment is related to the existence of a so-called symplectic-admissible form. The transformation theory for Hamilton-admissible systems is currently investigated. The purpose of this paper is to describe one aspect of this theory by identifying the class of transformations which preserve the structure of Hamilton-admissible equations. Necessary and sufficient conditions are established for a transformation to be structure preserving. Some particular cases are discussed and an example is worked out

Structural and Chemical Evolution of Li- and Mn-rich Layered Cathode Material

Energy Technology Data Exchange (ETDEWEB)

Zheng, Jianming; Xu, Pinghong; Gu, Meng; Xiao, Jie; Browning, Nigel D.; Yan, Pengfei; Wang, Chong M.; Zhang, Jiguang

2015-02-24

Lithium (Li)- and manganese-rich (LMR) layered-structure materials are very promising cathodes for high energy density lithium-ion batteries. However, their voltage fading mechanism and its relationships with fundamental structural changes are far from being sufficiently understood. Here we report the detailed phase transformation pathway in the LMR cathode (Li[Li0.2Ni0.2Mn0.6]O2) during cycling for the samples prepared by hydro-thermal assistant method. It is found the transformation pathway of LMR cathode is closely correlated to its initial structure and preparation conditions. The results reveal that LMR cathode prepared by HA approach experiences a phase transformation from the layered structure to a LT-LiCoO2 type defect spinel-like structure (Fd-3m space group) and then to a disordered rock-salt structure (Fm-3m space group). The voltage fade can be well correlated with the Li ion insertion into octahedral sites, rather than tetrahedral sites, in both defect spinel-like structure and disordered rock-salt structure. The reversible Li insertion/removal into/from the disordered rock-salt structure is ascribed to the Li excess environment that can satisfy the Li percolating in the disordered rock-salt structure despite the increased kinetic barrier. Meanwhile, because of the presence of a great amount of oxygen vacancies, a significant decrease of Mn valence is detected in the cycled particle, which is below that anticipated for a potentially damaging Jahn-Teller distortion (+3.5). Clarification of the phase transformation pathway, cation redistribution, oxygen vacancy and Mn valence change undoubtedly provides insights into a profound understanding on the voltage fade, and capacity degradation of LMR cathode. The results also inspire us to further enhance the reversibility of LMR cathode via improving its surface structural stability.

Evaluation of the Influence of Salt Treatment on the Structure of ...

African Journals Online (AJOL)

Evaluation of the Influence of Salt Treatment on the Structure of Pyrolyzed ... Studies to characterize the activated carbon were conducted at ambient conditions. ... as iodine number and porosity; and minimum values for parameters like pH and ...

Structural and thermal development of the Atlantic margin offshore Essaouira (Morocco) - evidence of salt extrusion and implications for hydrocarbon exploration

Science.gov (United States)

Neumaier, Martin; Littke, Raf; Kleine, Adrian; Schnabel, Michael; Reichert, Christian

2013-04-01

Along the east-west regional seismic line BGR11-202 (MIRROR campaign, 2011), several distinct salt diapirs and related structures can be identified close to the present day coast line. The subsalt structure is only very poorly imaged. Further offshore, rotated fault blocks are overlain by Mesozoic and Cenozoic sediments. Towards the west, the evidence for past volcanic activity is increasing (necks, dykes, and sills). The magnetic anomaly S1 is roughly situated west of the most western identifiable salt structure. The aim of our study is to describe and verify possible salt tectonic and related thermal models and the evolution of the petroleum systems. One salt structure in particular shows clear evidence of salt extrusion in the past. We explain the potential scenario of the salt diapir development and extrusion in a series of structurally restored sections: After deposition, probably within the syn-rift Liassic half grabens (not imaged), the salt quickly became instable due to differential loading, assisted by growing density contrast with the overburden. It forced its way up using weak zones—which could have been the active normal faults—while the overburden collapsed into the previously occupied space (salt withdrawal). Even though the salt was constantly rising, it did not reach the surface due to constant burial. Only once the sedimentation rate decreased—during the late Cretaceous and early Paleogene—the salt extruded and crept down the continental slope onto the hiatus unconformity. With the extrusion, the salt partly dissolved in contact with the ocean water, and a cap rock formed. The related paleorelief was buried by the detritical sediments provided by the Atlas orogenesis. At present day, these paleoreliefs still have a bathymetric expression, as they are providing an unstable underground and trigger normal faulting and local resedimentation. Also remobilization of the salt, even though strengthened by the cap rock, might be possible locally

De-icing salt contamination reduces urban tree performance in structural soil cells.

Science.gov (United States)

Ordóñez-Barona, Camilo; Sabetski, Vadim; Millward, Andrew A; Steenberg, James

2018-03-01

Salts used for de-icing roads and sidewalks in northern climates can have a significant impact on water quality and vegetation. Sub-surface engineering systems, such as structural soil cells, can regulate water runoff and pollutants, and provide the necessary soil volume and irrigation to grow trees. However, the ability of such systems to manage de-icing salt contamination, and the impact of this contamination on the trees growing in them, have not been evaluated. We report on an field investigation of de-icing salt contamination in structural cells in two street-revitalization projects in Toronto, Canada, and the impact of this contamination on tree performance. We analyzed soil chemistry and collected tree attributes; these data were examined together to understand the effect of salinity on tree mortality rates and foliar condition. Data collected from continuous soil salinity loggers from April to June for one of the two sites were used to determine whether there was a long-term accumulation of salts in the soils. Results for both sites indicate that both sites displayed high salinity and alkalinity, with levels elevated beyond those suggested before those reported to cause negative tree effects. For one site, trees that were alive and trees that had a better foliar condition had significantly lower levels of soil salinity and alkalinity than other trees. High salinity and alkalinity in the soil were also associated with lower nutrient levels for both sites. Although tests for salinity accumulation in the soils of one site were negative, a longer monitoring of the soil conditions within the soil cells is warranted. Despite structural cells being increasingly utilized for their dual role in storm-water management and tree establishment, there may be a considerable trade-off between storm-water management and urban-forest function in northern climates where de-icing salt application continues to be commonplace. Copyright © 2017 Elsevier Ltd. All rights reserved.

Molten salt actinide recycler and transforming system without and with Th–U support: Fuel cycle flexibility and key material properties

International Nuclear Information System (INIS)

Ignatiev, V.; Feynberg, O.; Gnidoi, I.; Merzlyakov, A.; Surenkov, A.; Uglov, V.; Zagnitko, A.; Subbotin, V.; Sannikov, I.; Toropov, A.; Afonichkin, V.; Bovet, A.; Khokhlov, V.; Shishkin, V.; Kormilitsyn, M.; Lizin, A.; Osipenko, A.

2014-01-01

Highlights: • We examine feasibility of MOSART system without and with U–Th support. • We experimentally studied key material properties to prove MOSART flowsheet. • MOSART potential as the system with flexible fuel cycle scenarios is emphasized. • MOSART can operate with different TRU loadings in transmuter or even breeder modes. - Abstract: A study is under progress to examine the feasibility of MOlten Salt Actinide Recycler and Transforming (MOSART) system without and with U–Th support fuelled with different compositions of transuranic elements (TRU) trifluorides from spent LWR fuel. New design options with homogeneous core and fuel salt with high enough solubility for transuranic elements trifluorides are being examined because of new goals. The paper has the main objective of presenting the fuel cycle flexibility of the MOSART system while accounting technical constrains and experimental data received in this study. A brief description is given of the experimental results on key physical and chemical properties of fuel salt and combined materials compatibility to satisfy MOSART system requirements

Molecular dynamics simulations of structural transformation of perfluorooctane sulfonate (PFOS) at water/rutile interfaces.

Science.gov (United States)

He, Guangzhi; Zhang, Meiyi; Zhou, Qin; Pan, Gang

2015-09-01

Concentration and salinity conditions are the dominant environmental factors affecting the behavior of perfluorinated compounds (PFCs) on the surfaces of a variety of solid matrices (suspended particles, sediments, and natural minerals). However, the mechanism has not yet been examined at molecular scales. Here, the structural transformation of perfluorooctane sulfonate (PFOS) at water/rutile interfaces induced by changes of the concentration level of PFOS and salt condition was investigated using molecular dynamics (MD) simulations. At low and intermediate concentrations all PFOS molecules directly interacted with the rutile (110) surface mainly by the sulfonate headgroups through electrostatic attraction, yielding a typical monolayer structure. As the concentration of PFOS increased, the molecules aggregated in a complex multi-layered structure, where an irregular assembling configuration was adsorbed on the monolayer structure by the van der Waals interactions between the perfluoroalkyl chains. When adding CaCl2 to the system, the multi-layered structure changed to a monolayer again, indicating that the addition of CaCl2 enhanced the critical concentration value to yield PFOS multilayer assemblies. The divalent Ca(2+) substituted for monovalent K(+) as the bridging counterion in PFOS adsorption. MD simulation may trigger wide applications in study of perfluorinated compounds (PFCs) from atomic/molecular scale. Copyright © 2015 Elsevier Ltd. All rights reserved.

Crystal structures of seven molecular salts derived from benzylamine and organic acidic components

Science.gov (United States)

Wen, Xianhong; Jin, Xiunan; Lv, Chengcai; Jin, Shouwen; Zheng, Xiuqing; Liu, Bin; Wang, Daqi; Guo, Ming; Xu, Weiqiang

2017-07-01

Cocrystallization of the commonly available organic amine, benzylamine, with a series of organic acids gave a total of seven molecular salts with the compositions: (benzylamine): (p-toluenesulfonic acid) (1) [(HL)+ · (tsa-)], (benzylamine): (o-nitrobenzoic acid) (2) [(HL+) · (onba)-], (benzylamine): (3,4-methylenedioxybenzoic acid) (3) [(HL+) · (mdba-)], (benzylamine): (mandelic acid) (4) [(HL+) · (mda-)], (benzylamine): (5-bromosalicylic acid)2(5) [(HL+) · (bsac-) · (Hbsac)], (benzylamine): (m-phthalic acid) (6) [(HL+) · (Hmpta-)], and (benzylamine)2: (trimesic acid) (7) [(HL+)2 · (Htma2-)]. The seven salts have been characterised by X-ray diffraction technique, IR, and elemental analysis, and the melting points of all the salts were also reported. And their structural and supramolecular aspects are fully analyzed. The result reveals that among the seven investigated crystals the NH2 groups in the benzylamine moieties are protonated when the organic acids are deprotonated, and the crystal packing is interpreted in terms of the strong charge-assisted Nsbnd H⋯O hydrogen bond formation between the ammonium and the deprotonated acidic groups. Except the Nsbnd H⋯O hydrogen bond, the Osbnd H⋯O hydrogen bonds (charge assisted or neutral) were also found at the salts 4-7. Further analysis of the crystal packing of the salts indicated that a different family of additional CHsbnd O/CH2sbnd O, CHsbnd π/CH2sbnd π, Osbnd O, and Osbnd Cπ associations contribute to the stabilization and expansion of the total high-dimensional (2D-3D) framework structures. For the coexistence of the various weak nonbonding interactions these structures adopted homo or hetero supramolecular synthons or both. Some classical supramolecular synthons, such as R42(8), R43(10) and R44(12), usually observed in organic solids of organic acids with amine, were again shown to be involved in constructing most of these hydrogen bonding networks.

Role of thermodynamic, kinetic and structural factors in the recrystallization behavior of amorphous erythromycin salts

Energy Technology Data Exchange (ETDEWEB)

Nanakwani, Kapil; Modi, Sameer R.; Kumar, Lokesh; Bansal, Arvind K., E-mail: akbansal@niper.ac.in

2014-04-01

Graphical abstract: - Highlights: • Crystallization kinetics of amorphous erythromycin salts was assessed. • Contribution of thermodynamic, kinetic and structural factors was evaluated. • Role of counterions on physical stability of amorphous salts was investigated. • Implications of the study: In rationalizing stabilization approach for amorphous form. - Abstract: Amorphous form has become an important drug delivery strategy for poorly water soluble drugs. However, amorphous form has inherent physical instability due to its tendency to recrystallize to stable crystalline form. In the present study, amorphous forms of erythromycin free base (ED) and its salts namely, stearate (ES), phosphate (EP) and thiocyanate (ET) were generated by in situ melt quenching and evaluated for their crystallization tendency. Salts were characterized for kinetic, thermodynamic and structural factors to understand crystallization behavior. Kinetics of crystallization followed the order as ES > EP > ET > ED. Fragility and molecular mobility does not completely explain these findings. However, configurational entropy (S{sub conf}), indicative of entropic barrier to crystallization, followed the order as ET > EP > ES > ED. Lower crystallization tendency of ED can be explained by its lower thermodynamic driving force for crystallization (H{sub conf}). This correlated well with different structural parameters for the counter ions.

Corundum-to-spinel structural phase transformation in alumina

Energy Technology Data Exchange (ETDEWEB)

Adachi, Shogo [Department of Materials Science and Engineering, Kyushu Institute of Technology, Fukuoka 804-8550 (Japan); Ishimaru, Manabu, E-mail: ishimaru@post.matsc.kyutech.ac.jp [Department of Materials Science and Engineering, Kyushu Institute of Technology, Fukuoka 804-8550 (Japan); Sina, Younes; McHargue, Carl J.; Sickafus, Kurt E. [Materials Science and Engineering Department, University of Tennessee, Knoxville, TN 37996-2200 (United States); Alves, Eduardo [Unit of Physics and Accelerators, Ion Beam Laboratory, Instituto Superior Técnico/Instituto Tecnológico e Nuclear, EN. 10 2686-953 Sacavém (Portugal)

2015-09-01

Several polymorphs exist in alumina (Al{sub 2}O{sub 3}), and they transform to a stable α-phase with a hexagonal corundum structure on thermal annealing. This structural change is irreversible as a function of temperature, and transformation of corundum to another metastable crystalline phase has never been observed by heat treatments. In this study, we irradiated single crystals of Al{sub 2}O{sub 3} with Zr ions and obtained an irradiated microstructure consisting of a buried α-Al{sub 2}O{sub 3} layer surrounded on top and bottom by layers of a defect cubic spinel Al{sub 2}O{sub 3} phase. We examined the thermal stability of this microstructure using transmission electron microscopy and X-ray diffraction. We found that the corundum phase completely transforms to the spinel phase following annealing at 1173 K for 1 h: the thermodynamically stable phase transforms to the metastable phase by heat treatments. We discuss this unusual structural change within the context of our results as well as previous observations.

Mixed sodium nickel-manganese sulfates: Crystal structure relationships between hydrates and anhydrous salts

Energy Technology Data Exchange (ETDEWEB)

Marinova, Delyana M.; Zhecheva, Ekaterina N.; Kukeva, Rositsa R.; Markov, Pavel V. [Institute of General and Inorganic Chemistry, Bulgarian Academy of Sciences, 1113 Sofia (Bulgaria); Nihtianova, Diana D. [Institute of General and Inorganic Chemistry, Bulgarian Academy of Sciences, 1113 Sofia (Bulgaria); Institute of Mineralogy and Crystallography, Bulgarian Academy of Sciences, 1113 Sofia (Bulgaria); Stoyanova, Radostina K., E-mail: radstoy@svr.igic.bas.bg [Institute of General and Inorganic Chemistry, Bulgarian Academy of Sciences, 1113 Sofia (Bulgaria)

2017-06-15

The present contribution provides new structural and spectroscopic data on the formation of solid solutions between hydrated and dehydrated sulfate salts of sodium-nickel and sodium-manganese in a whole concentration range: Na{sub 2}Ni{sub 1−x}Mn{sub x}(SO{sub 4}){sub 2}·yH{sub 2}O, 0≤ x≤1.0. Using powder XRD, electron paramagnetic resonance spectroscopy (EPR), IR and Raman spectroscopy it has been found that double sodium-nickel and sodium-manganese salts form solid solutions Na{sub 2}Ni{sub 1−x}Mn{sub x}(SO{sub 4}){sub 2}·4H{sub 2}O with a blödite-type of structure within a broad concentration range of 0≤x≤0.49, while the manganese rich compositions Na{sub 2}Ni{sub 1−x}Mn{sub x}(SO{sub 4}){sub 2}·2H{sub 2}O (0.97≤x≤1.0) crystallize in the kröhnkite-type of structure. The Ni-based blödites Na{sub 2}Ni{sub 1−x}Mn{sub x}(SO{sub 4}){sub 2}·4H{sub 2}O dehydrate between 140 and 260 °C into anhydrous salts Na{sub 2}Ni{sub 1−x}Mn{sub x}(SO{sub 4}){sub 2}, 0≤ x≤0.44, with a structure where Ni{sub 1−x}Mn{sub x}O{sub 6} octahedra are bridged into pairs by edge- and corner sharing SO{sub 4}{sup 2−} groups. Both TEM and EPR methods show that the Ni{sup 2+} and Mn{sup 2+} ions are homogenously distributed over three crystallographic positions of the large monoclinic cell. The dehydration of the kröhnkite phase Na{sub 2}Ni{sub 1−x}Mn{sub x}(SO{sub 4}){sub 2}·2H{sub 2}O yields the alluaudite phase Na{sub 2+δ}Mn{sub 2-δ/2}(SO{sub 4}){sub 3}, where the Na-to-Mn ratio decreases and all Ni{sup 2+} dopants are released from the structure. The process of the dehydration is discussed in terms of structural aspects taking into account the distortion degree of the Ni,MnO{sub 6} and SO{sub 4} polyhedra. - Graphical abstract: Thermal dehydration of the blödite phase Na{sub 2}Ni{sub 1−x}Mn{sub x}(SO{sub 4}){sub 2}·4H{sub 2}O (0≤ x≤0.49) yields nickel-manganese sulfates Na{sub 2}Ni{sub 1−x}Mn{sub x}(SO{sub 4}){sub 2} (0≤ x≤0.44) with

Molecular interactions between lecithin and bile salts/acids in oils and their effects on reverse micellization.

Science.gov (United States)

Njauw, Ching-Wei; Cheng, Chih-Yang; Ivanov, Viktor A; Khokhlov, Alexei R; Tung, Shih-Huang

2013-03-26

It has been known that the addition of bile salts to lecithin organosols induces the formation of reverse wormlike micelles and that the worms are similar to long polymer chains that entangle each other to form viscoelastic solutions. In this study, we further investigated the effects of different bile salts and bile acids on the growth of lecithin reverse worms in cyclohexane and n-decane. We utilized rheological and small-angle scattering techniques to analyze the properties and structures of the reverse micelles. All of the bile salts can transform the originally spherical lecithin reverse micelles into wormlike micelles and their rheological behaviors can be described by the single-relaxation-time Maxwell model. However, their efficiencies to induce the worms are different. In contrast, before phase separation, bile acids can induce only short cylindrical micelles that are not long enough to impart viscoelasticity. We used Fourier transform infrared spectroscopy to investigate the interactions between lecithin and bile salts/acids and found that different bile salts/acids employ different functional groups to form hydrogen bonds with lecithin. Such effects determine the relative positions of the bile salts/acids in the headgroups of lecithin, thus resulting in varying efficiencies to alter the effective critical packing parameter for the formation of wormlike micelles. This work highlights the importance of intermolecular interactions in molecular self-assembly.

Human deoxyhaemoglobin-2,3-diphosphoglycerate complex low-salt structure at 2.5 A resolution.

Science.gov (United States)

Richard, V; Dodson, G G; Mauguen, Y

1993-09-20

The haemoglobin-2,3-diphosphoglycerate complex structure has been solved at 2.5 A resolution using crystals grown from low-salt solutions. The results show some important differences with the precedent haemoglobin-2,3-diphosphoglycerate high-salt structure solved by Arnone. First, we observe a loss of symmetry in the binding site, secondly both of the lysine residues 82 beta interact with 2,3-diphosphoglycerate at the same time, each making two contacts. This level of interaction is in agreement with the functional behaviour of natural haemoglobin mutants with mutations at the 2,3-diphosphoglycerate binding site.

Morphology and anatomical structure of the larval salt gland of ...

African Journals Online (AJOL)

The general structure of the salt gland of nauplii cultured at 180 g/L disappeared. Semiquantitative APH-1 mRNA analysis indicated that the gene was expressed in all tested salinities. The expression did not change remarkably between 25 and 40 g/L salinities. As salinity increased, the gene was up regulated at 70 g/L and ...

Arenediazonium salts transformations in water media: Coming round to origins

OpenAIRE

Marina E. Trusova; Ksenia V. Kutonova; Victor V. Kurtukov; Victor D. Filimonov; Pavel S. Postnikov

2016-01-01

Aromatic diazonium salts belong to an important class of organic compounds. The chemistry of these compounds has been originally developed in aqueous media, but then chemists focused on new synthetic methods that utilize reactions of diazonium salts in organic solvents. However, according to the principles of green chemistry and resource-efficient technologies, the use of organic solvents should be avoided. This review summarizes new trends of diazonium chemistry in aqueous media that satisfy...

Salt supply to and significance of asymmetric salt diapirs

DEFF Research Database (Denmark)

Koyi, H.; Burliga, S.; Chemia, Zurab

2012-01-01

Salt diapirs can be asymmetric both internally and externally reflecting their evolution history. As such, this asymmetry bear a significant amount of information about the differential loading (± lateral forces) and in turn the salt supply that have shaped the diapir. In two dimensions......, In this study we compare results of analogue and numerical models of diapirs with two natural salt diapris (Klodawa and Gorleben diapirs) to explain their salt supply and asymmetric evolution. In a NW-SE section, the Gorleben salt diapir possesses an asymmetric external geometry represented by a large...... southeastern overhang due to salt extrusion during Middle Cretaceous followed by its burial in Tertiary. This external asymmetry is also reflected in the internal configuration of the diapir which shows different rates of salt flow on the two halves of the structure. The asymmetric external and internal...

Structural transformations in Ge{sub 2}Sb{sub 2}Te{sub 5} under high pressure and temperature

Energy Technology Data Exchange (ETDEWEB)

Mio, A. M.; Privitera, S., E-mail: stefania.privitera@imm.cnr.it; D' Arrigo, G.; Rimini, E. [IMM-CNR, Istituto per la Microelettronica e Microsistemi, Consiglio Nazionale delle Ricerche, Strada VIII 5, Zona Industriale, I-95121 Catania (Italy); Ceppatelli, M. [ICCOM-CNR, Istituto di Chimica dei Composti OrganoMetallici, Via Madonna del Piano 10, I-50019 Sesto Fiorentino (Italy); LENS, European Laboratory for Non-Linear Spectroscopy, Via Nello Carrara 1, I-50019 Sesto Fiorentino (Italy); Gorelli, F.; Santoro, M. [LENS, European Laboratory for Non-Linear Spectroscopy, Via Nello Carrara 1, I-50019 Sesto Fiorentino (Italy); INO-CNR, Istituto Nazionale di Ottica, Via Nello Carrara 1, I-50019 Sesto Fiorentino (Italy); Miritello, M. [MATIS-IMM-CNR, via S. Sofia 64, I-95123 Catania (Italy); Bini, R. [LENS, European Laboratory for Non-Linear Spectroscopy, Via Nello Carrara 1, I-50019 Sesto Fiorentino (Italy); Università degli Studi di Firenze, Via della Lastruccia 3, I-50019 Sesto Fiorentino (Italy)

2015-08-14

The structural transformations occurring in Ge{sub 2}Sb{sub 2}Te{sub 5} films heated at temperature up to 400 °C, and under hydrostatic pressure up to 12 GPa, have been investigated through in-situ X ray diffraction measurements. The adopted experimental conditions are close to those experienced by the phase change material during the SET (crystallization)/RESET (amorphization) processes in a nonvolatile memory device. The compression enhances the thermal stability of the amorphous phase, which remains stable up to 180 °C at 8 GPa and to 230 °C at 12 GPa. The structure of the crystalline phases is also modified, with the formation of a CsCl-type structure instead of rock-salt and of a GeS-type structure at the temperature at which usually the trigonal stable phase is formed. Overall, the stability of the stable phase appears to be more affected by the compression. We argue that the presence of weak bonds associated to the van der Waals gaps is a determining factor for the observed reduced stability.

The Role of Coulomb Interactions for Spin Crossover Behaviors and Crystal Structural Transformation in Novel Anionic Fe(III Complexes from a π-Extended ONO Ligand

Directory of Open Access Journals (Sweden)

Suguru Murata

2016-05-01

Full Text Available To investigate the π-extension effect on an unusual negative-charged spin crossover (SCO FeIII complex with a weak N2O4 first coordination sphere, we designed and synthesized a series of anionic FeIII complexes from a π-extended naphthalene derivative ligand. Acetonitrile-solvate tetramethylammonium (TMA salt 1 exhibited an SCO conversion, while acetone-solvate TMA salt 2 was in a high-spin state. The crystal structural analysis for 2 revealed that two-leg ladder-like cation-anion arrays derived from π-stacking interactions between π-ligands of the FeIII complex anion and Coulomb interactions were found and the solvated acetone molecules were in one-dimensional channels between the cation-anion arrays. A desolvation-induced single-crystal-to-single-crystal transformation to desolvate compound 2’ may be driven by Coulomb energy gain. Furthermore, the structural comparison between quasi-polymorphic compounds 1 and 2 revealed that the synergy between Coulomb and π-stacking interactions induces a significant distortion of coordination structure of 2.

Halide salts and their structural properties in presence of secondary amine based molecule: A combined experimental and theoretical analysis

Science.gov (United States)

Ghosh, Pritam; Hazra, Abhijit; Ghosh, Meenakshi; Chandra Murmu, Naresh; Banerjee, Priyabrata

2018-04-01

Biologically relevant halide salts and its solution state structural properties are always been significant. In general, exposure of halide salts into polar solution medium results in solvation which in turn separates the cationic and anionic part of the salt. However, the conventional behaviour of salts might alter in presence of any secondary amine based compound, i.e.; moderately strong Lewis acid. In its consequence, to investigate the effect of secondary amine based compound in the salt solution, novel (E)-2-(4-bromobenzylidene)-1-(perfluorophenyl) hydrazine has been synthesized and used as secondary amine source. The secondary amine compound interestingly shows a drastic color change upon exposure to fluoride salts owing to hydrogen bonding interaction. Several experimental methods, e.g.; SCXRD, UV-Vis, FT-IR, ESI-MS and DLS together with modern DFT (i.e.; DFT-D3) have been performed to explore the structural properties of the halide salts upon exposure to secondary amine based compound. The effect of counter cation of the fluoride salt in binding with secondary amine source has also been investigated.

Industrial structural transformation and carbon dioxide emissions in China

International Nuclear Information System (INIS)

Zhou, Xiaoyan; Zhang, Jie; Li, Junpeng

2013-01-01

Using provincial panel data from the period 1995–2009 to analyze the relationship between the industrial structural transformation and carbon dioxide emissions in China, we find that the first-order lag of industrial structural adjustment effectively reduced the emissions; technical progress itself did not reduce the emissions, but indirectly led to decreasing emissions through the upgrading and optimization of industrial structure. Foreign direct investment and intervention by local governments reduced carbon dioxide emissions, but urbanization significantly increased the emissions. Thus, industrial structural adjustment is an important component of the development of a low-carbon economy. In the context of industrial structural transformation, an effective way to reduce a region’s carbon dioxide emissions is to promote the upgrading and optimization of industrial structure through technical progress. Tighter environmental access policies, selective utilization of foreign direct investment, and improvements in energy efficiency can help to reduce carbon dioxide emissions. - Highlights: ► Relationship between the transformation of industrial structure and CO 2 emissions in China. ► Dynamic panel data model. ► Industrial structural adjustments can effectively reduce current CO 2 emissions. ► Technical progress leads to decreasing CO 2 emissions through upgrading of industrial structure

Acemetacin cocrystals and salts: structure solution from powder X-ray data and form selection of the piperazine salt

Directory of Open Access Journals (Sweden)

Palash Sanphui

2014-03-01

Full Text Available Acemetacin (ACM is a non-steroidal anti-inflammatory drug (NSAID, which causes reduced gastric damage compared with indomethacin. However, acemetacin has a tendency to form a less soluble hydrate in the aqueous medium. We noted difficulties in the preparation of cocrystals and salts of acemetacin by mechanochemical methods, because this drug tends to form a hydrate during any kind of solution-based processing. With the objective to discover a solid form of acemetacin that is stable in the aqueous medium, binary adducts were prepared by the melt method to avoid hydration. The coformers/salt formers reported are pyridine carboxamides [nicotinamide (NAM, isonicotinamide (INA, and picolinamide (PAM], caprolactam (CPR, p-aminobenzoic acid (PABA, and piperazine (PPZ. The structures of an ACM–INA cocrystal and a binary adduct ACM–PABA were solved using single-crystal X-ray diffraction. Other ACM cocrystals, ACM–PAM and ACM–CPR, and the piperazine salt ACM–PPZ were solved from high-resolution powder X-ray diffraction data. The ACM–INA cocrystal is sustained by the acid...pyridine heterosynthon and N—H...O catemer hydrogen bonds involving the amide group. The acid...amide heterosynthon is present in the ACM–PAM cocrystal, while ACM–CPR contains carboxamide dimers of caprolactam along with acid–carbonyl (ACM hydrogen bonds. The cocrystals ACM–INA, ACM–PAM and ACM–CPR are three-dimensional isostructural. The carboxyl...carboxyl synthon in ACM–PABA posed difficulty in assigning the position of the H atom, which may indicate proton disorder. In terms of stability, the salts were found to be relatively stable in pH 7 buffer medium over 24 h, but the cocrystals dissociated to give ACM hydrate during the same time period. The ACM–PPZ salt and ACM–nicotinamide cocrystal dissolve five times faster than the stable hydrate form, whereas the ACM–PABA adduct has 2.5 times faster dissolution rate. The pharmaceutically acceptable

Acemetacin cocrystals and salts: structure solution from powder X-ray data and form selection of the piperazine salt.

Science.gov (United States)

Sanphui, Palash; Bolla, Geetha; Nangia, Ashwini; Chernyshev, Vladimir

2014-03-01

Acemetacin (ACM) is a non-steroidal anti-inflammatory drug (NSAID), which causes reduced gastric damage compared with indomethacin. However, acemetacin has a tendency to form a less soluble hydrate in the aqueous medium. We noted difficulties in the preparation of cocrystals and salts of acemetacin by mechanochemical methods, because this drug tends to form a hydrate during any kind of solution-based processing. With the objective to discover a solid form of acemetacin that is stable in the aqueous medium, binary adducts were prepared by the melt method to avoid hydration. The coformers/salt formers reported are pyridine carboxamides [nicotinamide (NAM), isonicotinamide (INA), and picolinamide (PAM)], caprolactam (CPR), p-aminobenzoic acid (PABA), and piperazine (PPZ). The structures of an ACM-INA cocrystal and a binary adduct ACM-PABA were solved using single-crystal X-ray diffraction. Other ACM cocrystals, ACM-PAM and ACM-CPR, and the piperazine salt ACM-PPZ were solved from high-resolution powder X-ray diffraction data. The ACM-INA cocrystal is sustained by the acid⋯pyridine heterosynthon and N-H⋯O catemer hydrogen bonds involving the amide group. The acid⋯amide heterosynthon is present in the ACM-PAM cocrystal, while ACM-CPR contains carboxamide dimers of caprolactam along with acid-carbonyl (ACM) hydrogen bonds. The cocrystals ACM-INA, ACM-PAM and ACM-CPR are three-dimensional isostructural. The carboxyl⋯carboxyl synthon in ACM-PABA posed difficulty in assigning the position of the H atom, which may indicate proton disorder. In terms of stability, the salts were found to be relatively stable in pH 7 buffer medium over 24 h, but the cocrystals dissociated to give ACM hydrate during the same time period. The ACM-PPZ salt and ACM-nicotinamide cocrystal dissolve five times faster than the stable hydrate form, whereas the ACM-PABA adduct has 2.5 times faster dissolution rate. The pharmaceutically acceptable piperazine salt of acemetacin exhibits superior

Salts and Co-crystals of Theobromine and their phase ...

Indian Academy of Sciences (India)

Co-crystal; dissolution; phase transformation; salts; solubility; stability; synthon. ... Salts of theobromine with hydrochloric acid, phosphoric acid, methanesulfonic acid, benzenesulfonic acid and -toluenesulfonic acid were prepared using ... C. R. Rao Road, Gachibowli, Central University P.O., Hyderabad 500 046, India ...

A Study on Salt Attack Protection of Structural and Finishing Materials in Power Plant Structures

Energy Technology Data Exchange (ETDEWEB)

Kim, W.B.; Kweon, K.J.; Suh, Y.P.; Nah, H.S.; Lee, K.J.; Park, D.S.; Jo, Y.K. [Korea Electric Power Research Institute, Taejeon (Korea, Republic of)

1997-12-31

This is a final report written by both KEPRI and KICT as a co-operative research titled {sup A} study on Salt Protection of Structural and Finishings in Power Plant Structures{sup .} This study presented the methods to prevent the chloride-induced corrosion of power plant structures through collection and analysis of research datum relating to design, construction and maintenance for the prevention of structural and finishing materials, thru material performance tests for anti-corrosion under many kinds of chloride-induced corrosion environments. As a result, this study proposed the guidelines for design, construction and maintenance of power plant structures due to chloride-induced corrosion. (author). 257 refs., 111 figs., 86 tabs.

A Study on Salt Attack Protection of Structural and Finishing Materials in Power Plant Structures

Energy Technology Data Exchange (ETDEWEB)

Kim, W B; Kweon, K J; Suh, Y P; Nah, H S; Lee, K J; Park, D S; Jo, Y K [Korea Electric Power Research Institute, Taejeon (Korea, Republic of)

1998-12-31

This is a final report written by both KEPRI and KICT as a co-operative research titled {sup A} study on Salt Protection of Structural and Finishings in Power Plant Structures{sup .} This study presented the methods to prevent the chloride-induced corrosion of power plant structures through collection and analysis of research datum relating to design, construction and maintenance for the prevention of structural and finishing materials, thru material performance tests for anti-corrosion under many kinds of chloride-induced corrosion environments. As a result, this study proposed the guidelines for design, construction and maintenance of power plant structures due to chloride-induced corrosion. (author). 257 refs., 111 figs., 86 tabs.

Preparation and structural characterization of zwitterionic surfactant intercalated into NiZn-layered hydroxide salts

Science.gov (United States)

Liu, Jiexiang; Wang, Jianlong; Zhang, Xiaoguang; Fang, Binbin; Hu, Pan; Zhao, Xuyang

2015-10-01

Three zwitterionic surfactants, dodecyl dimethyl carboxylbetaine (DCB), dodecyl dimethyl sulfobetaine (DSB) and N-dodecyl-β-aminoprpionate (DAP), intercalated into NiZn-layered hydroxide salts (NZL-DCB, NZL-DSB and NZL-DAP) were synthesized by the coprecipitation method. The effect of surfactant content, pH, temperature and time of hydrothermal treatment on preparation was investigated and discussed. The NZL-DCB, NZL-DSB and NZL-DAP were characterized by powder X-ray diffraction (PXRD), Fourier transform infrared spectroscopy (FTIR), and thermogravimetry analysis and differential thermal analysis (TGA/DTA). The results showed that basal spacings of NZL-DCB, NZL-DSB and NZL-DAP were around 3.45, 3.68 and 3.94 nm, respectively. DCB, DSB and DAP probably form an overlapped bilayer in the gallery. TGA/DTA data indicated that NZL-DCB, NZL-DSB and NZL-DAP displayed three loss weight stages: loss of adsorbed and structural water, dehydroxylation of matrix and decomposition of nitrate ions, decomposition and combustion of surfactants. Furthermore, chemical analysis data, BET surface area and scanning electron microscopic (SEM) were also measured and analyzed.

Yeast functional screen to identify genes conferring salt stress tolerance in Salicornia europaea.

Science.gov (United States)

Nakahara, Yoshiki; Sawabe, Shogo; Kainuma, Kenta; Katsuhara, Maki; Shibasaka, Mineo; Suzuki, Masanori; Yamamoto, Kosuke; Oguri, Suguru; Sakamoto, Hikaru

2015-01-01

Salinity is a critical environmental factor that adversely affects crop productivity. Halophytes have evolved various mechanisms to adapt to saline environments. Salicornia europaea L. is one of the most salt-tolerant plant species. It does not have special salt-secreting structures like a salt gland or salt bladder, and is therefore a good model for studying the common mechanisms underlying plant salt tolerance. To identify candidate genes encoding key proteins in the mediation of salt tolerance in S. europaea, we performed a functional screen of a cDNA library in yeast. The library was screened for genes that allowed the yeast to grow in the presence of 1.3 M NaCl. We obtained three full-length S. europaea genes that confer salt tolerance. The genes are predicted to encode (1) a novel protein highly homologous to thaumatin-like proteins, (2) a novel coiled-coil protein of unknown function, and (3) a novel short peptide of 32 residues. Exogenous application of a synthetic peptide corresponding to the 32 residues improved salt tolerance of Arabidopsis. The approach described in this report provides a rapid assay system for large-scale screening of S. europaea genes involved in salt stress tolerance and supports the identification of genes responsible for such mechanisms. These genes may be useful candidates for improving crop salt tolerance by genetic transformation.

Yeast functional screen to identify genes conferring salt stress tolerance in Salicornia europaea

Directory of Open Access Journals (Sweden)

Yoshiki eNakahara

2015-10-01

Full Text Available Salinity is a critical environmental factor that adversely affects crop productivity. Halophytes have evolved various mechanisms to adapt to saline environments. Salicornia europaea L. is one of the most salt-tolerant plant species. It does not have special salt-secreting structures like a salt gland or salt bladder, and is therefore a good model for studying the common mechanisms underlying plant salt tolerance. To identify candidate genes encoding key proteins in the mediation of salt tolerance in S. europaea, we performed a functional screen of a cDNA library in yeast. The library was screened for genes that allowed the yeast to grow in the presence of 1.3 M NaCl. We obtained three full-length S. europaea genes that confer salt tolerance. The genes are predicted to encode (1 a novel protein highly homologous to thaumatin-like proteins, (2 a novel coiled-coil protein of unknown function, and (3 a novel short peptide of 32 residues. Exogenous application of a synthetic peptide corresponding to the 32 residues improved salt tolerance of Arabidopsis. The approach described in this report provides a rapid assay system for large-scale screening of S. europaea genes involved in salt stress tolerance and supports the identification of genes responsible for such mechanisms. These genes may be useful candidates for improving crop salt tolerance by genetic transformation.

Structural study of salt forms of amides; paracetamol, benzamide and piperine

Science.gov (United States)

Kennedy, Alan R.; King, Nathan L. C.; Oswald, Iain D. H.; Rollo, David G.; Spiteri, Rebecca; Walls, Aiden

2018-02-01

Single crystal x-ray diffraction has been used to investigate the structures of six complexes containing O-atom protonated cations derived from the pharmaceutically relevant amides benzamide (BEN), paracetamol (PAR) and piperine (PIP). The structures of the salt forms [PAR(H)][SO3C6H4Cl], [BEN(H)][O3SC6H4Cl] and [BEN(H)][Br]·H2O are reported along with those of the hemi-halide salt forms [PAR(H)][I3]. PAR, [PIP(H)][I3]·PIP and [PIP(H)][I3]0·5[I]0.5. PIP. The structure of the cocrystal BEN. HOOCCH2Cl is also presented for comparison. The geometry of the amide group is found to systematically change upon protonation, with the Cdbnd O distance increasing and the Csbnd N distance decreasing. The hemi-halide species all feature strongly hydrogen bonded amide(H)/amide pairs. The amide group Cdbnd O and Csbnd N distances for both elements of each such pair are intermediate between those found for simple neutral amide and protonated amide forms. It was found that crystallising paracetamol from aqueous solutions containing Ba2+ ions gave orthorhombic paracetamol.

Structure of tungsten electrodeposited from oxide chloride-fluoride molten salts

International Nuclear Information System (INIS)

Pavlovskij, V.A.; Reznichenko, V.A.

1998-01-01

Investigation results on the influence of electrolysis parameters and electrolyte composition on tungsten cathode deposit structure are presented. The electrolysis was performed in NaCl-NaF-WO 3 molten salts using tungsten and tungsten coated molybdenum cathodes. Morphological and metallographic studies of tungsten crystals were carrier out. Tungsten deposits were obtained in the form of crystalline conglomerates, sponge and high dispersity powder

Introducing improved structural properties and salt dependence into a coarse-grained model of DNA

Energy Technology Data Exchange (ETDEWEB)

Snodin, Benedict E. K., E-mail: benedict.snodin@chem.ox.ac.uk; Mosayebi, Majid; Schreck, John S.; Romano, Flavio; Doye, Jonathan P. K., E-mail: jonathan.doye@chem.ox.ac.uk [Physical and Theoretical Chemistry Laboratory, Department of Chemistry, University of Oxford, South Parks Road, Oxford OX1 3QZ (United Kingdom); Randisi, Ferdinando [Life Sciences Interface Doctoral Training Center, South Parks Road, Oxford OX1 3QU (United Kingdom); Rudolf Peierls Centre for Theoretical Physics, 1 Keble Road, Oxford OX1 3NP (United Kingdom); Šulc, Petr [Center for Studies in Physics and Biology, The Rockefeller University, 1230 York Avenue, New York, New York 10065 (United States); Ouldridge, Thomas E. [Department of Mathematics, Imperial College, 180 Queen’s Gate, London SW7 2AZ (United Kingdom); Tsukanov, Roman; Nir, Eyal [Department of Chemistry and the Ilse Katz Institute for Nanoscale Science and Technology, Ben-Gurion University of the Negev, Beer Sheva (Israel); Louis, Ard A. [Rudolf Peierls Centre for Theoretical Physics, 1 Keble Road, Oxford OX1 3NP (United Kingdom)

2015-06-21

We introduce an extended version of oxDNA, a coarse-grained model of deoxyribonucleic acid (DNA) designed to capture the thermodynamic, structural, and mechanical properties of single- and double-stranded DNA. By including explicit major and minor grooves and by slightly modifying the coaxial stacking and backbone-backbone interactions, we improve the ability of the model to treat large (kilobase-pair) structures, such as DNA origami, which are sensitive to these geometric features. Further, we extend the model, which was previously parameterised to just one salt concentration ([Na{sup +}] = 0.5M), so that it can be used for a range of salt concentrations including those corresponding to physiological conditions. Finally, we use new experimental data to parameterise the oxDNA potential so that consecutive adenine bases stack with a different strength to consecutive thymine bases, a feature which allows a more accurate treatment of systems where the flexibility of single-stranded regions is important. We illustrate the new possibilities opened up by the updated model, oxDNA2, by presenting results from simulations of the structure of large DNA objects and by using the model to investigate some salt-dependent properties of DNA.

Introducing improved structural properties and salt dependence into a coarse-grained model of DNA

International Nuclear Information System (INIS)

Snodin, Benedict E. K.; Mosayebi, Majid; Schreck, John S.; Romano, Flavio; Doye, Jonathan P. K.; Randisi, Ferdinando; Šulc, Petr; Ouldridge, Thomas E.; Tsukanov, Roman; Nir, Eyal; Louis, Ard A.

2015-01-01

We introduce an extended version of oxDNA, a coarse-grained model of deoxyribonucleic acid (DNA) designed to capture the thermodynamic, structural, and mechanical properties of single- and double-stranded DNA. By including explicit major and minor grooves and by slightly modifying the coaxial stacking and backbone-backbone interactions, we improve the ability of the model to treat large (kilobase-pair) structures, such as DNA origami, which are sensitive to these geometric features. Further, we extend the model, which was previously parameterised to just one salt concentration ([Na + ] = 0.5M), so that it can be used for a range of salt concentrations including those corresponding to physiological conditions. Finally, we use new experimental data to parameterise the oxDNA potential so that consecutive adenine bases stack with a different strength to consecutive thymine bases, a feature which allows a more accurate treatment of systems where the flexibility of single-stranded regions is important. We illustrate the new possibilities opened up by the updated model, oxDNA2, by presenting results from simulations of the structure of large DNA objects and by using the model to investigate some salt-dependent properties of DNA

Structural transformation in monolayer materials: a 2D to 1D transformation.

Science.gov (United States)

Momeni, Kasra; Attariani, Hamed; LeSar, Richard A

2016-07-20

Reducing the dimensions of materials to atomic scales results in a large portion of atoms being at or near the surface, with lower bond order and thus higher energy. At such scales, reduction of the surface energy and surface stresses can be the driving force for the formation of new low-dimensional nanostructures, and may be exhibited through surface relaxation and/or surface reconstruction, which can be utilized for tailoring the properties and phase transformation of nanomaterials without applying any external load. Here we used atomistic simulations and revealed an intrinsic structural transformation in monolayer materials that lowers their dimension from 2D nanosheets to 1D nanostructures to reduce their surface and elastic energies. Experimental evidence of such transformation has also been revealed for one of the predicted nanostructures. Such transformation plays an important role in bi-/multi-layer 2D materials.

Tidal events and salt-marsh structure influence black mangrove (Avicennia germinans) recruitment across an ecotone.

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Peterson, Jennifer M; Bell, Susan S

2012-07-01

Field experiments were conducted at a black mangrove-salt-marsh ecotone in southwest Florida (U.S.A.) to investigate retention of propagules of the black mangrove, Avicennia germinans, by salt-marsh plants as a mechanism of facilitation operating on recruitment success at landward boundaries. Buoyant A. germinans propagules are dispersed by tides, and stranding is required for establishment; therefore, processes that enable stranding should facilitate mangrove recruitment. We expected the physical structure of salt-marsh vegetation to define propagule retention capacity, and we predicted that salt-marsh plants with distinct growth forms would differentially retain propagules. Experimental monoculture plots (1 m2) of salt-marsh plants with different growth forms (Sporobolus virginicus [grass], Sesuvium portulacastrum [succulent forb], and Batis maritima [succulent scrub]) were created, and A. germinans propagules were emplaced into these plots and monitored over time. For comparison, propagules were also placed into natural polyculture plots (1 m2). Polyculture plots contained at least two of the salt-marsh plant taxa selected for monoculture treatments, and S. virginicus was always present within these polyculture plots. Natural polyculture plots retained 59.3% +/- 11.0% (mean +/- SE) of emplaced propagules. Monocultures varied in their propagule retention capacities with plots of S. virginicus retaining on average 65.7% +/- 11.5% of transplanted propagules compared to 7.2% +/- 1.8% by B. maritima and 5.0% +/- 1.9% by S. portulacastrum. Plots containing S. virginicus retained a significantly greater percentage of emplaced propagules relative to the two succulent salt-marsh taxa. Furthermore, propagule entrapment, across all treatments, was strongly correlated with salt-marsh structure (r2 = 0.6253, P = 0.00001), which was estimated using an indirect quantitative metric (lateral obstruction) calculated from digital images of plots. Overall, our findings imply that

Structure of eight molecular salts assembled from noncovalent bonding between carboxylic acids, imidazole, and benzimidazole

Science.gov (United States)

Jin, Shouwen; Zhang, Huan; Liu, Hui; Wen, Xianhong; Li, Minghui; Wang, Daqi

2015-09-01

Eight organic salts of imidazole/benzimidazole have been prepared with carboxylic acids as 2-methyl-2-phenoxypropanoic acid, α-ketoglutaric acid, 5-nitrosalicylic acid, isophthalic acid, 4-nitro-phthalic acid, and 3,5-dinitrosalicylic acid. The eight crystalline forms reported are proton-transfer compounds of which the crystals and compounds were characterized by X-ray diffraction analysis, IR, mp, and elemental analysis. These structures adopted hetero supramolecular synthons, with the most common R22(7) motif observed at salts 2, 3, 5, 6 and 8. Analysis of the crystal packing of 1-8 suggests that there are extensive strong Nsbnd H⋯O, and Osbnd H⋯O hydrogen bonds (charge assisted or neutral) between acid and imidazolyl components in all of the salts. Except the classical hydrogen bonding interactions, the secondary propagating interactions also play important roles in structure extension. This variety, coupled with the varying geometries and number of acidic groups of the acids utilized, has led to the creation of eight supramolecular arrays with 1D-3D structure. The role of weak and strong noncovalent interactions in the crystal packing is analyzed. The results presented herein indicate that the strength and directionality of the Nsbnd H⋯O, and Osbnd H⋯O hydrogen bonds between acids and imidazole/benzimidazole are sufficient to bring about the formation of organic salts.

Landscape Changes and a Salt Production Sustainable Approach in the State of Salt Pan Area Decreasing on the Coast of Tianjin, China

Directory of Open Access Journals (Sweden)

Hui Wang

2015-07-01

Full Text Available Landsat images from 1979, 1988, 1999, 2008, and 2013 were used to analyze the landscape area change of salt pans lying on the coast of Tianjin. While initially (1979–1988, the area of Tianjin’s salt pan increased, later (1988–2013 it declined dramatically. In the first phase (1979–1988 of the studied period the primary roll-in landscape of the salt pan wasbarren land with an area of 60.0 km2. By 1988, the area of Tianjin’s salt pan rose to 457.8 km2. The main roll-out landscape of the salt pan during 1988–2013 was urban, barren land, village/town, harbor, and road whose area amounted to 69.8, 35.9, 27.3, 25.5 and 18.4 km2 respectively. The roll-out barren land will be transformed to construction land ultimately. By 2013, the total loss reached 167.3 km2, which was 36.5% of the salt pan area of Tianjin in 1988. With the development of coastal economy, the salterns with a lower economic value were transformed to and replaced by land use types with a higher economic value. This trend would influence the production of sea salt and the development of sodium hydroxide and sodium carbonate industries. Seawater desalination provides an opportunity for the restoration and compensation of salt production capacity. Based on the theory of circular economy and industrial symbiosis, in this article an industrial symbiosis model for sea salt production and sea water desalination is explored: “mariculture–power plant cooling–seawater desalination–Artemia culture–bromide extraction–sea salt production–salt chemical industry”. Through the application of this process sustainable development of the sea salt production in Tianjin could be achieved.

Vinylphosphonium and 2-aminovinylphosphonium salts – preparation and applications in organic synthesis

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Anna Kuźnik

2017-12-01

Full Text Available The main synthetic routes towards vinylphosphonium salts and their wide applications in organic synthesis are discussed in this review. Particular attention is paid to the use of these compounds as building blocks for the synthesis of carbo- and heterocyclic systems after their prior transformation into the corresponding phosphorus ylides, followed by the intramolecular Wittig reaction with various types of nucleophiles containing a carbonyl function in their structures.

Structure and ionic conductivity of block copolymer electrolytes over a wide salt concentration range

Science.gov (United States)

Chintapalli, Mahati; Le, Thao; Venkatesan, Naveen; Thelen, Jacob; Rojas, Adriana; Balsara, Nitash

Block copolymer electrolytes are promising materials for safe, long-lasting lithium batteries because of their favorable mechanical and ion transport properties. The morphology, phase behavior, and ionic conductivity of a block copolymer electrolyte, SEO mixed with LiTFSI was studied over a wide, previously unexplored salt concentration range using small angle X-ray scattering, differential scanning calorimetry and ac impedance spectroscopy, respectively. SEO exhibits a maximum in ionic conductivity at twice the salt concentration that PEO, the homopolymer analog of the ion-containing block, does. This finding is contrary to prior studies that examined a more limited range of salt concentrations. In SEO, the phase behavior of the PEO block and LiTFSI closely resembles the phase behavior of homopolymer PEO and LiTFSI. The grain size of the block copolymer morphology was found to decrease with increasing salt concentration, and the ionic conductivity of SEO correlates with decreasing grain size. Structural effects impact the ionic conductivity-salt concentration relationship in block copolymer electrolytes. SEO: polystyrene-block-poly(ethylene oxide); also PS-PEO LiTFSI: lithium bis(trifluoromethanesulfonyl imide

The response of transgenic Brassica species to salt stress: a review.

Science.gov (United States)

Shah, Nadil; Anwar, Sumera; Xu, Jingjing; Hou, Zhaoke; Salah, Akram; Khan, Shahbaz; Gong, Jianfang; Shang, Zhengwei; Qian, Li; Zhang, Chunyu

2018-06-01

Salt stress is considered one of the main abiotic factors to limit crop growth and productivity by affecting morpho-physiological and biochemical processes. Genetically, a number of salt tolerant Brassica varieties have been developed and introduced, but breeding of such varieties is time consuming. Therefore, current focus is on transgenic technology, which plays an important role in the development of salt tolerant varieties. Various salt tolerant genes have been characterized and incorporated into Brassica. Therefore, such genetic transformation of Brassica species is a significant step for improvement of crops, as well as conferring salt stress resistance qualities to Brassica species. Complete genome sequencing has made the task of genetically transforming Brassica species easier, by identifying desired candidate genes. The present review discusses relevant information about the principles which should be employed to develop transgenic Brassica species, and also will recommend tools for improved tolerance to salinity.

Salt-modulated structure formation in a dense calcium caseinate system

NARCIS (Netherlands)

Grabowska, K.J.; Goot, van der A.J.; Boom, R.M.

2012-01-01

A 30 wt% calcium caseinate dispersion can be transformed in an anisotropic and fibrous structure by applying well-defined flow and enzymatic gelation. The formation of an anisotropic structure is thought to be due to the micellar structure of the caseinate and the mild adhesion between the micelles

Neutron scattering studies of pretransitional phenomena in structural phase transformations

International Nuclear Information System (INIS)

Shapiro, S.M.

1979-03-01

Materials exhibiting structural phase transformations are well known to possess pretransitional phenomena. Below the transition temperature, T/sub c/, an order parameter appears and the pretransitional effects are associated with the fluctuations of the order parameter. Neutron scattering techniques have proved invaluable in studying the temporal and spatial dependence of these fluctuations. SrTiO 3 is the prototypical example of a structural phase transformation exhibiting features observable in other transformations such as martensitic and order-disorder. The experimental evolution of the understanding of the phase transformation in SrTiO 3 will be reviewed and the features observed will be shown to typify other systems

Protective role of salt in catalysis and maintaining structure of halophilic proteins against denaturation

Science.gov (United States)

Sinha, Rajeshwari; Khare, Sunil K.

2014-01-01

Search for new industrial enzymes having novel properties continues to be a desirable pursuit in enzyme research. The halophilic organisms inhabiting under saline/ hypersaline conditions are considered as promising source of useful enzymes. Their enzymes are structurally adapted to perform efficient catalysis under saline environment wherein n0n-halophilic enzymes often lose their structure and activity. Haloenzymes have been documented to be polyextremophilic and withstand high temperature, pH, organic solvents, and chaotropic agents. However, this stability is modulated by salt. Although vast amount of information have been generated on salt mediated protection and structure function relationship in halophilic proteins, their clear understanding and correct perspective still remain incoherent. Furthermore, understanding their protein architecture may give better clue for engineering stable enzymes which can withstand harsh industrial conditions. The article encompasses the current level of understanding about haloadaptations and analyzes structural basis of their enzyme stability against classical denaturants. PMID:24782853

Solution, thermal and optical properties of bis(pyridinium salt)s as ionic liquids

International Nuclear Information System (INIS)

Jo, Tae Soo; Koh, Jung Jae; Han, Haesook; Bhowmik, Pradip K.

2013-01-01

Bis(pyridinium salt)s containing different alkyl chain lengths and various organic counterions were prepared by the ring-transmutation reaction of bis(pyrylium tosylate) with aliphatic amines in dimethyl sulfoxide at 130–135 °C for 18 h and their tosylate counterions were exchanged to other anions such as triflimide, methyl orange, and dioctyl sulfosuccinate by the metathesis reaction in a common organic solvent. Their chemical structures were established by using 1 H, 19 F, and 13 C NMR spectra. The thermal properties of bis(pyridinium salt)s were studied by DSC and TGA measurements. Some of the dicationic salts provided low melting points below 100 °C and some of them displayed amorphous properties. Polarized optical microscopy studies revealed the crystal structures prior to melting temperatures in some cases. Their optical properties were examined by using UV–Vis and photoluminescent spectrometers; and they emitted blue light both in the solution and solid states regardless of their microstructures, counterions, and the polarity of organic solvents. However, most of these salts exhibited hypsochromic shifts in their emission peaks in the solid state when compared with those of their solution spectra. Due to unique properties of methyl orange anion as a pH indicator, two of the salts showed different color change in varying concentrations of triflic acid in common organic solvents, demonstrating their potential use as an acid sensor in methanol, acetonitrile and acetone. Highlights: ► Luminescent dicationic salts were synthesized by ring-transmutation and metathesis reactions. ► Thermal and optical properties of dicationic salts are affected by the size of anion structures. ► Due to the methyl orange counterions, some dicationic salts showed pH- sensing property

Protein thermal stability enhancement by designing salt bridges: a combined computational and experimental study.

Directory of Open Access Journals (Sweden)

Chi-Wen Lee

Full Text Available Protein thermal stability is an important factor considered in medical and industrial applications. Many structural characteristics related to protein thermal stability have been elucidated, and increasing salt bridges is considered as one of the most efficient strategies to increase protein thermal stability. However, the accurate simulation of salt bridges remains difficult. In this study, a novel method for salt-bridge design was proposed based on the statistical analysis of 10,556 surface salt bridges on 6,493 X-ray protein structures. These salt bridges were first categorized based on pairing residues, secondary structure locations, and Cα-Cα distances. Pairing preferences generalized from statistical analysis were used to construct a salt-bridge pair index and utilized in a weighted electrostatic attraction model to find the effective pairings for designing salt bridges. The model was also coupled with B-factor, weighted contact number, relative solvent accessibility, and conservation prescreening to determine the residues appropriate for the thermal adaptive design of salt bridges. According to our method, eight putative salt-bridges were designed on a mesophilic β-glucosidase and 24 variants were constructed to verify the predictions. Six putative salt-bridges leaded to the increase of the enzyme thermal stability. A significant increase in melting temperature of 8.8, 4.8, 3.7, 1.3, 1.2, and 0.7°C of the putative salt-bridges N437K-D49, E96R-D28, E96K-D28, S440K-E70, T231K-D388, and Q277E-D282 was detected, respectively. Reversing the polarity of T231K-D388 to T231D-D388K resulted in a further increase in melting temperatures by 3.6°C, which may be caused by the transformation of an intra-subunit electrostatic interaction into an inter-subunit one depending on the local environment. The combination of the thermostable variants (N437K, E96R, T231D and D388K generated a melting temperature increase of 15.7°C. Thus, this study

Assessment by X-ray diffraction the process of bentonite organophilization using a different quaternary ammonium salts

International Nuclear Information System (INIS)

Silva, L.A. da; Rosario, J.A. do; Lima, R.B.; Milioli, C.C.; Gusatti, M.; Linhares, R.H.; Kuhnen, N.C.; Riella, H.G.

2010-01-01

The process was conducted in an organophilization Bentonite originated from the Company of Industrial Minerals of Mozambique Ltd. (Mimoc). The transformation of bentonite organophilic clay were performed in laboratory procedures that aim to mechanochemical exchange of Na + and Ca 2+ from the interlayer space of clay minerals by cations of quaternary ammonium salts. In this study we used two types of salts, which are: the cetyl trimethyl ammonium chloride and alkyl dimethyl benzyl ammonium chloride at different concentrations (30, 50, 80, 100 meq/100 g clay). The natural bentonite and organophilic clay samples were characterized by X-ray diffraction (XRD) to obtain the mineralogical constituents and analysis phases of the increase in interlayer distance confirming the incorporation of quaternary ammonium salts in the structure of clays. (author)

Evidence for a temperature-driven structural transformation in liquid bismuth

International Nuclear Information System (INIS)

Greenberg, Y.; Dariel, M.P.; Greenberg, Y.; Yahel, E.; Caspi, E.N.; Makov, G.; Benmore, C.; Beuneu, B.

2009-01-01

The thermodynamic properties of liquid bismuth have been explored from the melting point to 1100 C degrees by high-resolution measurements of the density, the heat capacity and the static structure factor. These physical properties display a number of anomalies. In particular, we have observed evidence for the presence of a temperature-driven liquid-liquid structural transformation that takes place at ambient pressure. The latter is characterized by a density discontinuity that occurs at 740 C degrees. Differential thermal analysis measurements revealed the endo-thermal nature of this transformation. A rearrangement of liquid bismuth structure was found by neutron diffraction measurements, supporting the existence of a liquid-liquid transformation far above the liquidus. (authors)

Numerical estimation of structural integrity of salt cavern wells.

NARCIS (Netherlands)

Orlic, B.; Thienen-Visser, K. van; Schreppers, G.J.

2016-01-01

Finite element analyses were performed to estimate axial deformation of cavern wells due to gas storage operations in solution-mined salt caverns. Caverns shrink over time due to salt creep and the cavern roof subsides potentially threatening well integrity. Cavern deformation, deformation of salt

Molten salt breeder reactor

International Nuclear Information System (INIS)

1977-01-01

MSBR Study Group formed in October 1974 has studied molten salt breeder reactor and its various aspects. Usage of a molten salt fuel, extremely interesting as reactor chemistry, is a great feature to MSBR; there is no need for separate fuel making, reprocessing, waste storage facilities. The group studied the following, and these results are presented: molten salt technology, molten salt fuel chemistry and reprocessing, reactor characteristics, economy, reactor structural materials, etc. (Mori, K.)

The expression of Millettia pinnata chalcone isomerase in Saccharomyces cerevisiae salt-sensitive mutants enhances salt-tolerance.

Science.gov (United States)

Wang, Hui; Hu, Tangjin; Huang, Jianzi; Lu, Xiang; Huang, Baiqu; Zheng, Yizhi

2013-04-24

The present study demonstrates a new Millettia pinnata chalcone isomerase (MpCHI) whose transcription level in leaf was confirmed to be enhanced after being treated by seawater or NaCl (500 mM) via transcriptome sequencing and Real-Time Quantitative Reverse Transcription PCR (QRT-PCR) analyses. Its full length cDNA (666 bp) was obtained by 3'-end and 5'-end Rapid Amplification of cDNA Ends (RACE). The analysis via NCBI BLAST indicates that both aminoacid sequence and nucleotide sequence of the MpCHI clone share high homology with other leguminous CHIs (73%-86%). Evolutionarily, the phylogenic analysis further revealed that the MpCHI is a close relative of leguminous CHIs. The MpCHI protein consists of 221 aminoacid (23.64 KDa), whose peptide length, amino acid residues of substrate-binding site and reactive site are very similar to other leguminous CHIs reported previously. Two pYES2-MpCHI transformed salt-sensitive Saccharomyces cerevisiae mutants (Δnha1 and Δnhx1) showed improved salt-tolerance significantly compared to pYES2-vector transformed yeast mutants, suggesting the MpCHI or the flavonoid biosynthesis pathway could regulate the resistance to salt stress in M. pinnata.

Extension of love wave transformation theory to laterally heterogeneous structures

International Nuclear Information System (INIS)

Romanelli, F.; Panza, G.F.

1993-08-01

By means of the spherical-to-flat transformations for torsional waves, all the flat-transformed components of motion (two for displacement and five for stress) have been derived. This provides the formal basis necessary to treat the propagation of torsional waves in spherical 3-D structures, by using the existing flat-structure computational techniques. (author). 8 refs, 1 fig., 1 tab

The impact of natural transformation on adaptation in spatially structured bacterial populations.

Science.gov (United States)

Moradigaravand, Danesh; Engelstädter, Jan

2014-06-20

Recent studies have demonstrated that natural transformation and the formation of highly structured populations in bacteria are interconnected. In spite of growing evidence about this connection, little is known about the dynamics of natural transformation in spatially structured bacterial populations. In this work, we model the interdependency between the dynamics of the bacterial gene pool and those of environmental DNA in space to dissect the effect of transformation on adaptation. Our model reveals that even with only a single locus under consideration, transformation with a free DNA fragment pool results in complex adaptation dynamics that do not emerge in previous models focusing only on the gene shuffling effect of transformation at multiple loci. We demonstrate how spatial restriction on population growth and DNA diffusion in the environment affect the impact of transformation on adaptation. We found that in structured bacterial populations intermediate DNA diffusion rates predominantly cause transformation to impede adaptation by spreading deleterious alleles in the population. Overall, our model highlights distinctive evolutionary consequences of bacterial transformation in spatially restricted compared to planktonic bacterial populations.

Simple surface structure determination from Fourier transforms of angle-resolved photoemission extended fine structure

Energy Technology Data Exchange (ETDEWEB)

Zheng, Y. [Pennsylvania State Univ., University Park, PA (United States)]|[Lawrence Berkeley Lab., CA (United States); Shirley, D.A. [Pennsylvania State Univ., University Park, PA (United States)

1995-02-01

The authors show by Fourier analyses of experimental data, with no further treatment, that the positions of all the strong peaks in Fourier transforms of angle-resolved photoemission extended fine structure (ARPEFS) from adsorbed surfaces can be explicitly predicted from a trial structure with an accuracy of about {+-} 0.3 {angstrom} based on a single-scattering cluster model together with the concept of a strong backscattering cone, and without any additional analysis. This characteristic of ARPEFS Fourier transforms can be developed as a simple method for determining the structures of adsorbed surfaces to an accuracy of about {+-} 0.1 {angstrom}.

Indoor transformer stations and ELF magnetic field exposure: use of transformer structural characteristics to improve exposure assessment.

Science.gov (United States)

Okokon, Enembe Oku; Roivainen, Päivi; Kheifets, Leeka; Mezei, Gabor; Juutilainen, Jukka

2014-01-01

Previous studies have shown that populations of multiapartment buildings with indoor transformer stations may serve as a basis for improved epidemiological studies on the relationship between childhood leukaemia and extremely-low-frequency (ELF) magnetic fields (MFs). This study investigated whether classification based on structural characteristics of the transformer stations would improve ELF MF exposure assessment. The data included MF measurements in apartments directly above transformer stations ("exposed" apartments) in 30 buildings in Finland, and reference apartments in the same buildings. Transformer structural characteristics (type and location of low-voltage conductors) were used to classify exposed apartments into high-exposure (HE) and intermediate-exposure (IE) categories. An exposure gradient was observed: both the time-average MF and time above a threshold (0.4 μT) were highest in the HE apartments and lowest in the reference apartments, showing a statistically significant trend. The differences between HE and IE apartments, however, were not statistically significant. A simulation exercise showed that the three-category classification did not perform better than a two-category classification (exposed and reference apartments) in detecting the existence of an increased risk. However, data on the structural characteristics of transformers is potentially useful for evaluating exposure-response relationship.

Ice crystallization in ultrafine water-salt aerosols: nucleation, ice-solution equilibrium, and internal structure.

Science.gov (United States)

Hudait, Arpa; Molinero, Valeria

2014-06-04

Atmospheric aerosols have a strong influence on Earth's climate. Elucidating the physical state and internal structure of atmospheric aqueous aerosols is essential to predict their gas and water uptake, and the locus and rate of atmospherically important heterogeneous reactions. Ultrafine aerosols with sizes between 3 and 15 nm have been detected in large numbers in the troposphere and tropopause. Nanoscopic aerosols arising from bubble bursting of natural and artificial seawater have been identified in laboratory and field experiments. The internal structure and phase state of these aerosols, however, cannot yet be determined in experiments. Here we use molecular simulations to investigate the phase behavior and internal structure of liquid, vitrified, and crystallized water-salt ultrafine aerosols with radii from 2.5 to 9.5 nm and with up to 10% moles of ions. We find that both ice crystallization and vitrification of the nanodroplets lead to demixing of pure water from the solutions. Vitrification of aqueous nanodroplets yields nanodomains of pure low-density amorphous ice in coexistence with vitrified solute rich aqueous glass. The melting temperature of ice in the aerosols decreases monotonically with an increase of solute fraction and decrease of radius. The simulations reveal that nucleation of ice occurs homogeneously at the subsurface of the water-salt nanoparticles. Subsequent ice growth yields phase-segregated, internally mixed, aerosols with two phases in equilibrium: a concentrated water-salt amorphous mixture and a spherical cap-like ice nanophase. The surface of the crystallized aerosols is heterogeneous, with ice and solution exposed to the vapor. Free energy calculations indicate that as the concentration of salt in the particles, the advance of the crystallization, or the size of the particles increase, the stability of the spherical cap structure increases with respect to the alternative structure in which a core of ice is fully surrounded by

Bile salts as semiochemicals in fish

Science.gov (United States)

Buchinger, Tyler J.; Li, Weiming; Johnson, Nicholas S.

2014-01-01

Bile salts are potent olfactory stimuli in fishes; however the biological functions driving such sensitivity remain poorly understood. We provide an integrative review of bile salts as semiochemicals in fish. First, we present characteristics of bile salt structure, metabolism, and function that are particularly relevant to chemical communication. Bile salts display a systematic pattern of structural variation across taxa, are efficiently synthesized, and are stable in the environment. Bile salts are released into the water via the intestine, urinary tract, or gills, and are highly water soluble. Second, we consider the potential role of bile salts as semiochemicals in the contexts of detecting nearby fish, foraging, assessing risk, migrating, and spawning. Lastly, we suggest future studies on bile salts as semiochemicals further characterize release into the environment, behavioral responses by receivers, and directly test the biological contexts underlying olfactory sensitivity.

Features of the Calculation Deployment Large Transformable Structures of Different Configurations

Directory of Open Access Journals (Sweden)

V. N. Zimin

2014-01-01

Full Text Available Despite the significant progress achieved in the design of space transformable structures to ensure a smooth and reliable deployment remains an important task. This type of construction can consist of dozens, hundreds or even thousands of interconnected elements. Deployment transformable space structures in orbit to test their performance in orbital conditions are associated with high material costs. Full deploy: experimental development process transformable structures involve a number of fundamental difficulties: It is impossible to eliminate the influence of gravity and resistance forces conditions. Thus, to calculate deploy of large transformable structures of various configurations is an important stage of their creation. Simulation provides an opportunity to analyze various schemes of deploy, to reveal their advantages and possible disadvantages. For numerical analysis of deploy of such structures is necessary to use modern software modeling of the dynamics of multi-component of mechanical systems such as EULER and Adams. Simulation of deployment space transformable structures was performed taking as example folding flat antenna contours diameter of 5 m and 20 m, foldable spatial calibration reflector diameter of 3 m, deployable antenna reflector truss-type aperture 3×6 m.The results of the calculations represent following characteristics: the time of adoption of the working position structures; form intermediate positions structures during deployment; dependence of opening angles and angular velocities of the design links on the time. The parameters of these calculations can be used as input in the development of structural elements providing deployment. They can also be used to prepare stands for experimental testing of disclosure designs in ground conditions. It should be noted that the theoretical models are the only way to analyze the deployment of such structures for possible emergency situations.

Synthesis, structural, solubility and anticancer activity studies of salts using nucleobases and sulfonic acids coformer

Science.gov (United States)

Singh, Neetu; Singh, Udai P.; Nikhil, Kumar; Roy, Partha; Singh, Hariji

2017-10-01

The reactions of natural and unnatural nucleobases (cytosine (Cyt), adenine (Ade), 5-aminouracil (AU) and caffeine (Caff)) with sulfonic acids coformer (1,5-naphthalenedisulfonic acid, NDSA; 5-sulfosalicylic acid, SSA) resulted in the formation of salts viz. [NDSA.Cyt] (1), [NDSA.Ade] (2), [NDSA.AU] (3), [NDSA.Caff] (4), [SSA.Cyt] (5), [SSA.Ade] (6), [SSA.AU] (7), and [SSA.Caff] (8). The structural analysis revealed that salts 1, 4, 6 and 7 have intermolecular interactions between adjacent nucleobases which form two different homodimer shown in R22 (8) motif and assembled via complementary Nsbnd H⋯O and Nsbnd H⋯N interactions. However, in all other salts an intermediate supramolecular synthon pattern was observed between nucleobases and sulfonic acids. The lattice energy was also calculated by DFT to investigate whether salts were thermodynamically more stable than its coformer. The same was further confirmed by differential scanning calorimetry-thermogravimetric (DSC-TG) analysis. The anticancer activity study of individual nucleobases and their NDSA salts were also performed on human breast (MCF-7) and lung (A 549) cancer cell. The salts formation of nucleobases with sulfonic acids improved their solubility, thereby demonstrating up to 8-fold increase in solubility of nucleobases.

A first-principles study of half-metallic ferromagnetism in binary alkaline-earth nitrides with rock-salt structure

International Nuclear Information System (INIS)

Gao, G.Y.; Yao, K.L.; Liu, Z.L.; Zhang, J.; Min, Y.; Fan, S.W.

2008-01-01

In this Letter, using the first-principles full-potential linearized augmented plane-wave (FP-LAPW) method, we extend the electronic structure and magnetism studies on zinc-blende structure of II-V compounds MX (M=Ca,Sr,Ba; X=N,P,As) [M. Sieberer, J. Redinger, S. Khmelevskyi, P. Mohn, Phys. Rev. B 73 (2006) 024404] to the rock-salt structure. It is found that, in the nine compounds, only alkaline-earth nitrides CaN, SrN and BaN exhibit ferromagnetic half-metallic character with a magnetic moment of 1.00μ B per formula unit. Furthermore, compared with the zinc-blende structure of CaN, SrN and BaN, the rock-salt structure has lower energy, which makes them more promising candidates of possible growth of half-metallic films on suitable substrates

Study of the Formation of Eutectic Melt of Uranium and Thermal Analysis for the Salt Distillation of Uranium Deposits

International Nuclear Information System (INIS)

Park, Sung Bin; Hwang, Sung Chan; Kang, Young Ho; Park, Ki Min; Jun, Wan Gi; Lee, Han Soo; Cho, Dong Wook

2010-01-01

Uranium deposits from an electrorefining process contain about 30% salt. In order to recover pure uranium and transform it into an ingot, the salts have to be removed from the uranium deposits. Major process variables for the salt distillation process of the uranium deposits are hold temperature and vacuum pressure. Effects of the variables on the salt removal efficiency were studied in the previous study 1. By applying the Hertz-Langmuir relation to the salt evaporation of the uranium deposits, the evaporation coefficients were obtained at the various conditions. The operational conditions for achieving above 99% salt removal were deduced. The salt distilled uranium deposits tend to form the eutectic melt with iron, nickel, chromium for structural material of salt evaporator. In this study, we investigated the hold temperature limitation in order to prevent the formation of the eutectic melt between uranium and other metals. The reactions between the uranium metal and stainless steel were tested at various conditions. And for enhancing the evaporation rate of the salt and the efficient recovery of the distilled salt, the thermal analysis of the salt distiller was conducted by using commercial CFX software. From the thermal analysis, the effect of Ar gas flow on the evaporation of the salt was studied.

Salt bridges: geometrically specific, designable interactions.

Science.gov (United States)

Donald, Jason E; Kulp, Daniel W; DeGrado, William F

2011-03-01

Salt bridges occur frequently in proteins, providing conformational specificity and contributing to molecular recognition and catalysis. We present a comprehensive analysis of these interactions in protein structures by surveying a large database of protein structures. Salt bridges between Asp or Glu and His, Arg, or Lys display extremely well-defined geometric preferences. Several previously observed preferences are confirmed, and others that were previously unrecognized are discovered. Salt bridges are explored for their preferences for different separations in sequence and in space, geometric preferences within proteins and at protein-protein interfaces, co-operativity in networked salt bridges, inclusion within metal-binding sites, preference for acidic electrons, apparent conformational side chain entropy reduction on formation, and degree of burial. Salt bridges occur far more frequently between residues at close than distant sequence separations, but, at close distances, there remain strong preferences for salt bridges at specific separations. Specific types of complex salt bridges, involving three or more members, are also discovered. As we observe a strong relationship between the propensity to form a salt bridge and the placement of salt-bridging residues in protein sequences, we discuss the role that salt bridges might play in kinetically influencing protein folding and thermodynamically stabilizing the native conformation. We also develop a quantitative method to select appropriate crystal structure resolution and B-factor cutoffs. Detailed knowledge of these geometric and sequence dependences should aid de novo design and prediction algorithms. Copyright © 2010 Wiley-Liss, Inc.

Charge density wave instabilities and incommensurate structural phase transformations

International Nuclear Information System (INIS)

Axe, J.D.

1977-10-01

Incommensurate structural phase transformations involve the appearance of modulated atomic displacements with spatial periodicity unrelated to the fundamental periodicity of the basic lattice. In the case of some quasi one- or two-dimensional metals such transformations are the result of Fermi-surface instabilities that also produce electronic charge density waves (CDW's) and soft phonon modes due to metallic electron screening singularities. Incommensurate soft mode instabilities have been found in insulators as well. Recent neutron scattering studies of both the statics and dynamics of incommensurate structural instabilities will be reviewed

Development of salt tolerant plants through genetic engineering (abstract)

International Nuclear Information System (INIS)

Mukhtar, Z.; Khan, S.A.; Zafar, Y.

2005-01-01

Salinity stress is one of the most serious factors limiting the productivity of agricultural crops. Genetic engineering provides a useful tool for tailoring plants with enhanced salt tolerance characteristics. Many organisms have evolved mechanisms to survive and grow under such extreme environments. These organisms provide us with a useful source of genes which can be used to improve salt tolerance in plants. The present study aims at identification and cloning of useful halo tolerance conferring genes from fungi and plants and to develop salt tolerant transgenic plants. Here we describe the cloning and use of HSR1 gene (a yeast transcription factor known to confer salt tolerance) and Na/sup +//H/sup +/ antiporter gene AtNHX1 (3016 bp) from Arabidopsis thaliana, and transformation of tobacco with HSR1 and AtNHX1 genes through Agrobacterium method. A number of transgenic tobacco plants were regenerated from leaf explants transformed with Agrobacterium tumefaciens (LBA4404) having HSR1 and AtNHX1 genes by leaf disc method. The putative transgenic plants were analyzed by PCR and dot blot analysis. Screening of these transgenic plants at different salinity levels is in progress which will help identify the suitable plant lines and thus the promising genes which can be further exploited to engineer salt tolerant crop plants. (author)

Phase field theory of proper displacive phase transformations: Structural anisotropy and directional flexibility, a vector model, and the transformation kinetics

Energy Technology Data Exchange (ETDEWEB)

Rao Weifeng [Department of Materials Science and Engineering, Rutgers University, 607 Taylor Road, Piscataway, NJ 08854 (United States); Khachaturyan, Armen G., E-mail: khach@jove.rutgers.edu [Department of Materials Science and Engineering, Rutgers University, 607 Taylor Road, Piscataway, NJ 08854 (United States)

2011-06-15

A phase field theory of proper displacive transformations is developed to address the microstructure evolution and its response to applied fields in decomposing and martensitic systems. The theory is based on the explicit equation for the non-equilibrium free energy function of the transformation strain obtained by a consistent separation of the total strain into transformation and elastic strains. The transformation strain is considered to be a relaxing long-range order parameter evolving in accordance with the system energetics rather than as a fixed material constant used in the conventional Eshelby theory of coherent inclusions. The elastic strain is defined as a coherency strain recovering the crystal lattice compatibility. The obtained free energy function of the transformation strain leads to the concepts of structural anisotropy and directional flexibility of low symmetry phases. The formulated vector model of displacive transformation makes apparent a similarity between proper displacive transformation and ferromagnetic/ferroelectric transformation and, in particular, a similarity between the structural anisotropy and magnetic/polar anisotropy of ferromagnetic/ferroelectric materials. It even predicts the feasibility of a glass-like structural state with unlimited directional flexibility of the transformation strain that is conceptually similar to a ferromagnetic glass. The thermodynamics of the equilibrium between low symmetry phases and the thermodynamic conditions leading to the formation of adaptive states are formulated.

Solid state linear dichroic infrared spectral analysis of benzimidazoles and their N 1-protonated salts

Science.gov (United States)

Ivanova, B. B.

2005-11-01

A stereo structural characterization of 2,5,6-thrimethylbenzimidazole (MBIZ) and 2-amino-benzimidaziole (2-NH 2-BI) and their N 1 protonation salts was carried out using a polarized solid state linear dichroic infrared spectral (IR-LD) analysis in nematic liquid crystal suspension. All experimental predicted structures were compared with the theoretical ones, obtained by ab initio calculations. The Cs to C2v* symmetry transformation as a result of protonation processes, with a view of its reflection on the infrared spectral characteristics was described.

Genetic transformation of Populus tomentosa to improve salt tolerance

Science.gov (United States)

Ningxia Du; Xin Liu; Yun Li; Shouyi Chen; Jinsong Zhang; Da Ha; Wenguang Deng; Chunkui Sun; Yingzhi Zhang; Paula M Pijut

2012-01-01

Soil salinity can be a limiting factor for productivity in agriculture and forestry. In order to fully utilize saline lands productively in plantation forestry for pulp production, the genetic modification of tree species for salt tolerance may be required. The AhDREB1 gene, a DREB-like transcription factor gene, was transferred into ...

The Expression of Millettia pinnata Chalcone Isomerase in Saccharomyces cerevisiae Salt-Sensitive Mutants Enhances Salt-Tolerance

Directory of Open Access Journals (Sweden)

Baiqu Huang

2013-04-01

Full Text Available The present study demonstrates a new Millettia pinnata chalcone isomerase (MpCHI whose transcription level in leaf was confirmed to be enhanced after being treated by seawater or NaCl (500 mM via transcriptome sequencing and Real-Time Quantitative Reverse Transcription PCR (QRT-PCR analyses. Its full length cDNA (666 bp was obtained by 3'-end and 5'-end Rapid Amplification of cDNA Ends (RACE. The analysis via NCBI BLAST indicates that both aminoacid sequence and nucleotide sequence of the MpCHI clone share high homology with other leguminous CHIs (73%–86%. Evolutionarily, the phylogenic analysis further revealed that the MpCHI is a close relative of leguminous CHIs. The MpCHI protein consists of 221 aminoacid (23.64 KDa, whose peptide length, amino acid residues of substrate-binding site and reactive site are very similar to other leguminous CHIs reported previously. Two pYES2-MpCHI transformed salt-sensitive Saccharomyces cerevisiae mutants (Δnha1 and Δnhx1 showed improved salt-tolerance significantly compared to pYES2-vector transformed yeast mutants, suggesting the MpCHI or the flavonoid biosynthesis pathway could regulate the resistance to salt stress in M. pinnata.

Corrosion of candidate iron-base waste package structural barrier materials in moist salt environments

International Nuclear Information System (INIS)

Westerman, R.E.; Pitman, S.G.

1984-11-01

Mild steels are considered to be strong candidates for waste package structural barrier (e.g., overpack) applications in salt repositories. Corrosion rates of these materials determined in autoclave tests utilizing a simulated intrusion brine based on Permian Basin core samples are low, generally <25 μm (1 mil) per year. When the steels are exposed to moist salts containing simulated inclusion brines, the corrosion rates are found to increase significantly. The magnesium in the inclusion brine component of the environment is believed to be responsible for the increased corrosion rates. 1 reference, 4 figures, 2 tables

Structural and theoretical investigations of 3,4,5-triamino-1,2,4-triazolium salts

Energy Technology Data Exchange (ETDEWEB)

Drake, Gregory W. [Propulsion Research Laboratory XD22, Marshall Space Flight Center, AL 35812 (United States); Hawkins, Tommy W.; Hall, Leslie A.; Boatz, Jerry A.; Brand, Adam J. [AFRL/PRSP Space and Missile Propulsion Division, 10 East Saturn Boulevard, Edwards AFB, CA 93524 (United States)

2005-10-01

Reactions using the high nitrogen heterocycle 3,4,5-triamino-1,2,4-triazole (guanazine) with strong acids (HNO{sub 3}, HClO{sub 4}, and ''HN(NO{sub 2}){sub 2}'') resulted in a family of highly stable salts. All of the salts were characterized using spectroscopic as well as single crystal X-ray diffraction studies. The X-ray structures were compared to that obtained from theoretical calculations (MP2/6-311+G(d, p) level). Initial safety testing (impact, friction) was carried out on all of the new materials. (Abstract Copyright [2005], Wiley Periodicals, Inc.)

Mechanical stratification of autochthonous salt: Implications from basin-scale numerical models of rifted margin salt tectonics

Science.gov (United States)

Ings, Steven; Albertz, Markus

2014-05-01

Deformation of salt and sediments owing to the flow of weak evaporites is a common phenomenon in sedimentary basins worldwide, and the resulting structures and thermal regimes have a significant impact on hydrocarbon exploration. Evaporite sequences ('salt') of significant thickness (e.g., >1km) are typically deposited in many cycles of seawater inundation and evaporation in restricted basins resulting in layered autochthonous evaporite packages. However, analogue and numerical models of salt tectonics typically treat salt as a homogeneous viscous material, often with properties of halite, the weakest evaporite. In this study, we present results of two-dimensional plane-strain numerical experiments designed to illustrate the effects of variable evaporite viscosity and embedded frictional-plastic ('brittle') sediment layers on the style of salt flow and associated deformation of the sedimentary overburden. Evaporite viscosity is a first-order control on salt flow rate and the style of overburden deformation. Near-complete evacuation of low-viscosity salt occurs beneath expulsion basins, whereas significant salt is trapped when viscosity is high. Embedded frictional-plastic sediment layers (with finite yield strength) partition salt flow and develop transient contractional structures (folds, thrust faults, and folded faults) in a seaward salt-squeeze flow regime. Multiple internal sediment layers reduce the overall seaward salt flow during sediment aggradation, leaving more salt behind to be re-mobilized during subsequent progradation. This produces more seaward extensive allochthonous salt sheets. If there is a density difference between the embedded layers and the surrounding salt, then the embedded layers 'fractionate' during deformation and either float to the surface or sink to the bottom (depending on density), creating a thick zone of pure halite. Such a process of 'buoyancy fractionation' may partially explain the apparent paradox of layered salt in

Laser induced structural transformation in chalcogenide based superlattices

Energy Technology Data Exchange (ETDEWEB)

Zallo, Eugenio, E-mail: zallo@pdi-berlin.de; Wang, Ruining; Bragaglia, Valeria; Calarco, Raffaella [Paul-Drude-Institut für Festkörperelektronik, Hausvogteiplatz 5-7, 10117 Berlin (Germany)

2016-05-30

Superlattices made of alternating layers of nominal GeTe and Sb{sub 2}Te{sub 3} have been studied by micro-Raman spectroscopy. A structural irreversible transformation into ordered GeSbTe alloy is induced by high power laser light exposure. The intensity ratio of anti-Stokes and Stokes scattering under laser illumination gives a maximum average temperature in the sample of 177 °C. The latter is lower than the growth temperature and of 400 °C necessary by annealing to transform the structure in a GeSbTe alloy. The absence of this configuration after in situ annealing even up to 300 °C evidences an electronic excitation induced-transition which brings the system into a different and stable crystalline state.

Laser induced structural transformation in chalcogenide based superlattices

International Nuclear Information System (INIS)

Zallo, Eugenio; Wang, Ruining; Bragaglia, Valeria; Calarco, Raffaella

2016-01-01

Superlattices made of alternating layers of nominal GeTe and Sb 2 Te 3 have been studied by micro-Raman spectroscopy. A structural irreversible transformation into ordered GeSbTe alloy is induced by high power laser light exposure. The intensity ratio of anti-Stokes and Stokes scattering under laser illumination gives a maximum average temperature in the sample of 177 °C. The latter is lower than the growth temperature and of 400 °C necessary by annealing to transform the structure in a GeSbTe alloy. The absence of this configuration after in situ annealing even up to 300 °C evidences an electronic excitation induced-transition which brings the system into a different and stable crystalline state.

The structure of salt bridges between Arg(+) and Glu(-) in peptides investigated with 2D-IR spectroscopy: Evidence for two distinct hydrogen-bond geometries.

Science.gov (United States)

Huerta-Viga, Adriana; Amirjalayer, Saeed; Domingos, Sérgio R; Meuzelaar, Heleen; Rupenyan, Alisa; Woutersen, Sander

2015-06-07

Salt bridges play an important role in protein folding and in supramolecular chemistry, but they are difficult to detect and characterize in solution. Here, we investigate salt bridges between glutamate (Glu(-)) and arginine (Arg(+)) using two-dimensional infrared (2D-IR) spectroscopy. The 2D-IR spectrum of a salt-bridged dimer shows cross peaks between the vibrational modes of Glu(-) and Arg(+), which provide a sensitive structural probe of Glu(-)⋯Arg(+) salt bridges. We use this probe to investigate a β-turn locked by a salt bridge, an α-helical peptide whose structure is stabilized by salt bridges, and a coiled coil that is stabilized by intra- and intermolecular salt bridges. We detect a bidentate salt bridge in the β-turn, a monodentate one in the α-helical peptide, and both salt-bridge geometries in the coiled coil. To our knowledge, this is the first time 2D-IR has been used to probe tertiary side chain interactions in peptides, and our results show that 2D-IR spectroscopy is a powerful method for investigating salt bridges in solution.

Spectroscopic and structural studies on some divalent metal salt of p-aminobenzoic acid (ABA(MG)) tetracyanonickelate complexes

International Nuclear Information System (INIS)

Atalay, Y.

2004-01-01

Infrared spectra of MLNi (CN) 4 [ M=Mn, Fe, Co, Ni, Zn or Cd and LDivalent metal salt of p- Aminobenzoic Acid or ABA (Mg) ] are reported. Their structure consists of polymeric layers of [M-Ni(CN) 4 ] α with the divalent metal salt of p-aminobenzoic acid [ABA(Mg)] molecules bound directly to the metal (M). These spectra were comparewith powder the Xray diffraction pattern of complexes. It is show that proposed structures for these complexes derived from Mattson 1000 FTIR spectra are consistent with the X-ray powder diffraction measurements and elemental analysis result

Computer simulation of the structural transformation in liquid Al2O3

International Nuclear Information System (INIS)

Vo Van Hoang; Oh, Suhk Kun

2005-01-01

We investigate the pressure-induced structural transformation in liquid Al 2 O 3 by a molecular dynamics (MD) method. Simulations were done in the basic cube, under periodic boundary conditions, containing 3000 ions with Born-Mayer-type pair potentials. The structure of the liquid Al 2 O 3 model with a real density at ambient pressure is in good agreement with Landron's experiment. In order to study the structural transformation, seven models of liquid alumina at temperature 2500 K and at densities in the range 2.80-4.5 g cm -3 have been built. The microstructure of Al 2 O 3 systems has been analysed through the pair radial distribution functions, coordination number distributions, interatomic distances and bond-angle distributions. And we found clear evidence of a structural transition in liquid alumina from a tetrahedral to an octahedral network. According to our results, this transformation occurred at densities in the range 3.6-4.5 g cm -3 . We also obtained an anomalous density dependence of the self-diffusion constant in the region of the structural transformation

Investigations on PVdF- HFP - PEMA polymer blend electrolytes doped with different lithium salts

Science.gov (United States)

Manojkumar Ubarhande, Radha; Bhattacharya, Shreya; Usha Rani, M.; Shanker Babu, Ravi; Krishnaveni, S.

2017-11-01

Plasticized polymer blend electrolytes were prepared by incorporating poly (vinylidenefluoride-co-hexafluoropropylene)(PVdF-HFP) and poly(ethylmethacrylate) (PEMA) complexed with plasticizer (PC) and different lithium salts such as LiClO4, LiBF4, LiCF3SO3 and LiN (CF3SO2)2) using solution-casting technique. X-ray diffraction and Fourier transform infra-red techniques confirms the structural characters and complex formation of the polymer electrolytes respectively. AC impedance analysis was carried out for all the samples in the range303-373K. The results suggest that among the various lithium salts, LiN (CF3SO2)2) based electrolytes exhibited the highest ionic conductivity (3.17 × 10-3 Scm-1).

Structural transformations on N-acetylneuraminic acid

International Nuclear Information System (INIS)

Schmid, W.

1986-01-01

Structural transformations on N-Acetylneuraminic acid are of special interest because of the biological importance of this compound. Although many stereo- and regioselective variations (especially for pyranoid derivatives) have been reported, no detailed studies of the furanoid derivatives from N-Acetylneuramino-1, 4-lactone diethyl dithioacetal have been described hitherto. Therefore a series of derivatives of the Neu5Ac-lactone diethyl dithioacetal has been investigated by n.m.r. spectroscopic techniques. The complete assignment of the 1 H and 13 C resonances was achieved by relaxation time measurements, decoupling experiments and 2-D - shiftcorrelation spectroscopy. The influence of different substituents on the conformational behavior is also discussed. For the Tetra-O-Acetyl-N-acetylneuraminic acid-γ-lactone diethyl dithioacetal the conformation in solution could be determined. The observed data were explained by a zigzag conformation of the backbone as described for the acetylated mannose diethyl dithioacetal. The synthesis of the tetrazole-analogue of N-Acetylneuraminic acid is also described. This compound is of special biological interest because there is a similarity in acidity between the carboxyl-group and the tetrazole-function and the metabolic stability of the tetrazole function is enhanced in comparison with the carboxyl-group. Many of the biological functions of N-Acetylneuraminic acid are connected with the presence of the carboxyl-group. It was therefore interesting to transform this group to the bioisostere tetrazole-function to investigate the influence of the tetrazole-group of this compound on biological activity in the future. During the application of protective groups in the field of Neuraminic acid chemistry a new compound, an ortholactone-derivative of Neu5Ac, was discovered. It's structure is similar to an adamantanecage and the chemistry of such an orthoester function opens new possibilities for structural transformations on N

Salt evaporation behaviors of uranium deposits from an electrorefiner

International Nuclear Information System (INIS)

Sung Bin Park; Dong Wook Cho; Gyu Hwan Oh; Sung Chan Hwang; Young Ho Kang; Hansoo Lee; Eung Ho Kim; Seong-Won Park; Jong Hyeon Lee

2010-01-01

From an electrorefining process, uranium deposits were recovered at the solid cathode of an electrorefining system. The uranium deposits from the electrorefiner contained about 30-40 wt% salts. In order to recover pure uranium and transform it into metal ingots, these salts have to be removed. A salt distiller was adapted for a salt evaporation. A batch operation for the salt removal was carried out by a heating and a vacuum evaporation. The operational conditions were a 700-1,000 deg C hold temperature and less than a 1 Torr under Argon atmosphere, respectively. The behaviors of the salt evaporations were investigated by focusing on the effects of the pressure and the holding temperature for the salt distillation. The removal efficiencies of the salts were obtained with regard to the operational conditions. The experimental results of the salt evaporations were evaluated by using the Hertz-Langmuir relation. The effective evaporation coefficients of this relation were obtained with regards to the vacuum pressures and the hold temperatures. The higher the vacuum pressure and the higher the holding temperature were, the higher the removal efficiencies of the salts were. (author)

Nitrogen-rich salts of 5,5‧-bistetrazole-1,1‧-diolate: Syntheses, structures and properties

Science.gov (United States)

Yang, Ting; Zhang, Jian-Guo; Zhang, Zhi-Bin; Gozin, Michael

2018-03-01

A series of new nitrogen-rich energetic salts containing 1H,1‧H-[5,5‧-bitetrazole]-1,1‧-diol (BTO) anion and ethane-1,2-diaminium (1), 1-amino-1H-1,2,3-triazol-3-ium (2), 4-amino-4H-1,2,4-triazol-1-ium (3) and 4,5-diamino-4H-1,2,4-triazol-1-ium (4) cations were synthesized by direct salt formation or by metathesis strategy. The structures of energetic salts 1-4 were comprehensively characterized by elemental analysis, mass spectrometry, IR and NMR spectroscopies and by X-ray crystallography. DSC and TGA methods were used to study thermal properties of these salts. Additionally, the non-isothermal kinetic parameters and thermodynamic parameters were calculated by utilizing the Kissinger's and Ozawa-Doyle's methods. The enthalpies of formation for all target compounds in this study were calculated, and their sensitivity to mechanical impact and friction was tested according to BAM guidelines. We found these new energetic salts exhibit good thermal stability and have typical decomposition temperatures above 230 °C, except for the salt 2. All our salts have highly-positive enthalpies of formation (311.1-473.6 kJ mol-1) and are insensitive to impact and friction stimuli (>40 J, 120 N). With a high nitrogen-rich content, high enthalpy of formation, good thermostability and very low sensitivity to impact, some of these new salts may have a potential for application in the field of environmentally friendly insensitive energetic materials.

Computer simulation on molten ionic salts

International Nuclear Information System (INIS)

Kawamura, K.; Okada, I.

1978-01-01

The extensive advances in computer technology have since made it possible to apply computer simulation to the evaluation of the macroscopic and microscopic properties of molten salts. The evaluation of the potential energy in molten salts systems is complicated by the presence of long-range energy, i.e. Coulomb energy, in contrast to simple liquids where the potential energy is easily evaluated. It has been shown, however, that no difficulties are encountered when the Ewald method is applied to the evaluation of Coulomb energy. After a number of attempts had been made to approximate the pair potential, the Huggins-Mayer potential based on ionic crystals became the most often employed. Since it is thought that the only appreciable contribution to many-body potential, not included in Huggins-Mayer potential, arises from the internal electrostatic polarization of ions in molten ionic salts, computer simulation with a provision for ion polarization has been tried recently. The computations, which are employed mainly for molten alkali halides, can provide: (1) thermodynamic data such as internal energy, internal pressure and isothermal compressibility; (2) microscopic configurational data such as radial distribution functions; (3) transport data such as the diffusion coefficient and electrical conductivity; and (4) spectroscopic data such as the intensity of inelastic scattering and the stretching frequency of simple molecules. The computed results seem to agree well with the measured results. Computer simulation can also be used to test the effectiveness of a proposed pair potential and the adequacy of postulated models of molten salts, and to obtain experimentally inaccessible data. A further application of MD computation employing the pair potential based on an ionic model to BeF 2 , ZnCl 2 and SiO 2 shows the possibility of quantitative interpretation of structures and glass transformation phenomena

Salt tectonics in Santos Basin, Brazil

Energy Technology Data Exchange (ETDEWEB)

Quirk, David G.; Nielsen, Malene; Raven, Madeleine [Maersk Oil and Gas, Copenhagen (Denmark); Menezes, Paulo [Maersk Oil and Gas, Rio de Janeiro, RJ (Brazil)

2008-07-01

From Albian to end Cretaceous times, the inboard part of the Santos Basin in Brazil was affected by extension as salt flowed basinwards under the effect of gravity. Salt rollers, flip-flop salt diapirs and the famous Albian Gap were all formed by this process. Outboard of these extensional structures, contraction was taken up in a wide zone of thickened salt where salt collected. The overburden was carried on top of the salt as it flowed down-dip, with up to 40 km of translation recorded in Albian strata. (author)

Regularities of radium coprecipitation with barium sulfate from salt solutions

International Nuclear Information System (INIS)

Kudryavskij, Yu.P.; Rakhimova, O.V.

2007-01-01

Coprecipitation of radium with barium sulfate from highly concentrated NaCl solutions is studied, including the effects of the initial solution composition, alkaline reagent (CaO, NaOH), supporting electrolyte (NaCl) concentration, and pH. The process is promoted by high NaCl concentration in the initial solution, which is due to structural transformation and change in the sorption activity of the BaSO 4 precipitate in salt solutions. The results obtained were applied to recovery of radium from process solutions during the development and introduction of improved procedure for disinfection and decontamination of waste yielded by chlorination of loparite concentrates [ru

The utility of petroleum seismic exploration data in delineating structural features within salt anticlines

Science.gov (United States)

Stockton, S.L.; Balch, Alfred H.

1978-01-01

The Salt Valley anticline, in the Paradox Basin of southeastern Utah, is under investigation for use as a location for storage of solid nuclear waste. Delineation of thin, nonsalt interbeds within the upper reaches of the salt body is extremely important because the nature and character of any such fluid- or gas-saturated horizons would be critical to the mode of emplacement of wastes into the structure. Analysis of 50 km of conventional seismic-reflection data, in the vicinity of the anticline, indicates that mapping of thin beds at shallow depths may well be possible using a specially designed adaptation of state-of-the-art seismic oil-exploration procedures. Computer ray-trace modeling of thin beds in salt reveals that the frequency and spatial resolution required to map the details of interbeds at shallow depths (less than 750 m) may be on the order of 500 Hz, with surface-spread lengths of less than 350 m. Consideration should be given to the burial of sources and receivers in order to attenuate surface noise and to record the desired high frequencies. Correlation of the seismic-reflection data with available well data and surface geology reveals the complex, structurally initiated diapir, whose upward flow was maintained by rapid contemporaneous deposition of continental clastic sediments on its flanks. Severe collapse faulting near the crests of these structures has distorted the seismic response. Evidence exists, however, that intrasalt thin beds of anhydrite, dolomite, and black shale are mappable on seismic record sections either as short, discontinuous reflected events or as amplitude anomalies that result from focusing of the reflected seismic energy by the thin beds; computer modeling of the folded interbeds confirms both of these as possible causes of seismic response from within the salt diapir. Prediction of the seismic signatures of the interbeds can be made from computer-model studies. Petroleum seismic-reflection data are unsatisfactory for

Structural evidence for solvent-stabilisation by aspartic acid as a mechanism for halophilic protein stability in high salt concentrations.

Science.gov (United States)

Lenton, Samuel; Walsh, Danielle L; Rhys, Natasha H; Soper, Alan K; Dougan, Lorna

2016-07-21

Halophilic organisms have adapted to survive in high salt environments, where mesophilic organisms would perish. One of the biggest challenges faced by halophilic proteins is the ability to maintain both the structure and function at molar concentrations of salt. A distinct adaptation of halophilic proteins, compared to mesophilic homologues, is the abundance of aspartic acid on the protein surface. Mutagenesis and crystallographic studies of halophilic proteins suggest an important role for solvent interactions with the surface aspartic acid residues. This interaction, between the regions of the acidic protein surface and the solvent, is thought to maintain a hydration layer around the protein at molar salt concentrations thereby allowing halophilic proteins to retain their functional state. Here we present neutron diffraction data of the monomeric zwitterionic form of aspartic acid solutions at physiological pH in 0.25 M and 2.5 M concentration of potassium chloride, to mimic mesophilic and halophilic-like environmental conditions. We have used isotopic substitution in combination with empirical potential structure refinement to extract atomic-scale information from the data. Our study provides structural insights that support the hypothesis that carboxyl groups on acidic residues bind water more tightly under high salt conditions, in support of the residue-ion interaction model of halophilic protein stabilisation. Furthermore our data show that in the presence of high salt the self-association between the zwitterionic form of aspartic acid molecules is reduced, suggesting a possible mechanism through which protein aggregation is prevented.

A new method of application of hydrated salts on textiles to achieve thermoregulating properties

International Nuclear Information System (INIS)

Kazemi, Zeinab; Mortazavi, Sayed Majid

2014-01-01

Graphical abstract: - Highlights: • No need to microencapsulate the salt. • New method Glauber's salt dehydration. • Supercooling decreased, heat storage increased. - Abstract: Recently there has been a lot of attention to fibers and fabrics with thermoregulatory effects. We can acquire this quality using Phase Change Materials (PCM). In this investigation a simple method was used to keep Na 2 SO 4 ·10H 2 O as an inorganic PCM on textile structure. By this method it is not necessary for PCMs to be microencapsulated. Thermophysical properties and thermal stability effects of treated fabric was checked out by differential scanning calorimetry (DSC) and thermo gravimetric analysis (TGA). Fourier transform infrared spectroscopy (FT-IR) and X-ray diffractometry (XRD) analysis were used to study the chemical structure of the fabric with PCMs. The air transfer, water permeability, and some physical properties of treated fabric were also investigated. The results showed that, silicone rubber polymer could be applied on textile structure to hold PCM without microencapsulating, and treated textile can be served as an appropriate smart thermal insulator

A new method of application of hydrated salts on textiles to achieve thermoregulating properties

Energy Technology Data Exchange (ETDEWEB)

Kazemi, Zeinab; Mortazavi, Sayed Majid, E-mail: mortaza@cc.iut.ac.ir

2014-08-10

Graphical abstract: - Highlights: • No need to microencapsulate the salt. • New method Glauber's salt dehydration. • Supercooling decreased, heat storage increased. - Abstract: Recently there has been a lot of attention to fibers and fabrics with thermoregulatory effects. We can acquire this quality using Phase Change Materials (PCM). In this investigation a simple method was used to keep Na{sub 2}SO{sub 4}·10H{sub 2}O as an inorganic PCM on textile structure. By this method it is not necessary for PCMs to be microencapsulated. Thermophysical properties and thermal stability effects of treated fabric was checked out by differential scanning calorimetry (DSC) and thermo gravimetric analysis (TGA). Fourier transform infrared spectroscopy (FT-IR) and X-ray diffractometry (XRD) analysis were used to study the chemical structure of the fabric with PCMs. The air transfer, water permeability, and some physical properties of treated fabric were also investigated. The results showed that, silicone rubber polymer could be applied on textile structure to hold PCM without microencapsulating, and treated textile can be served as an appropriate smart thermal insulator.

Erbium Salts as Non-Toxic Catalysts Compatible with Alternative Reaction Media

Directory of Open Access Journals (Sweden)

Manuela Oliverio

2018-03-01

Full Text Available Green catalysts must be non-toxic, easy to manage, able to be recovered and reused, active under alternative reaction conditions and cheap. Erbium salts meet all the previously listed characteristics and today they are emerging as a valuable catalytic solution to a number of organic transformations needing a Lewis acid catalyst in wet conditions or under alternative heating sources. This review aims to summarize the application of erbium salts in green organic transformations, with particular emphasis on their versatility under both homogeneous and heterogeneous conditions. The erbium salts’ role in bifunctional catalysis is also presented.

Structural transformations in MoOx thin films grown by pulsed laser deposition

International Nuclear Information System (INIS)

Camacho-Lopez, M.A.; Haro-Poniatowski, E.; Escobar-Alarcon, L.

2004-01-01

In this work, laser-induced crystallization in MoO x thin films (1.8≤x≤2.1) is reported. This transformation involves a MoO x oxidation and subsequently a crystallization process from amorphous MoO 3 to crystalline αMoO 3 . For comparison purposes crystallization is induced thermally, in an oven, as well. The crystallization kinetics is monitored by Raman spectroscopy; a threshold in the energy density necessary to induce the phase transformation is determined in the case of photo-crystallization. This threshold depends on the type of substrate on which the film is deposited. For the thin films deposited on glass substrates, the structural transformation is from amorphous MoO x to the thermodynamically stable αMoO 3 crystalline phase. For the thin films deposited on Si(100) the structural transformation is from amorphous MoO x to a mixture of αMoO 3 and the thermodynamically unstable βMoO 3 crystalline phases. The structural transformations are also characterized by scanning electron microscopy and light-transmission experiments. (orig.)

A novel structure of transmission line pulse transformer with mutually coupled windings.

Science.gov (United States)

Yu, Binxiong; Su, Jiancang; Li, Rui; Zhao, Liang; Zhang, Xibo; Wang, Junjie

2014-03-01

A novel structure of transmission line transformer (TLT) with mutually coupled windings is described in this paper. All transmission lines except the first stage of the transformer are wound on a common ferrite core for the TLT with this structure. A referral method was introduced to analyze the TLT with this structure, and an analytic expression of the step response was derived. It is shown that a TLT with this structure has a significantly slower droop rate than a TLT with other winding structures and the number of ferrite cores needed is largely reduced. A four-stage TLT with this structure was developed, whose input and output impedance were 4.2 Ω and 67.7 Ω, respectively. A frequency response test of the TLT was carried out. The test results showed that pulse response time of the TLT is several nanoseconds. The TLT described in this paper has the potential to be used as a rectangle pulse transformer with very fast response time.

Characterization of swollen structure of high-density polyelectrolyte brushes in salt solution by neutron reflectivity

Energy Technology Data Exchange (ETDEWEB)

Kobayashi, Motoyasu; Takahara, Atsushi [Institute for Materials Chemistry and Engineering, Kyushu University, 744 Motooka, Nishi-ku, Fukuoka 819-0395 (Japan); Terayama, Yuki [Graduate School of Engineering, Kyushu University (Japan); Hino, Masahiro [Reactor Research Institute, Kyoto University (Japan); Ishihara, Kazuhiko, E-mail: takahara@cstf.kyushu-u.ac.j [Graduate School of Engineering, University of Tokyo (Japan)

2009-08-01

Zwitterionic and cationic polyelectrolyte brushes on quartz substrate were prepared by surface-initiated atom transfer radical polymerization of 2-(methacryloyloxy)ethyl phosphorylcholine (MPC) and 2-(methacryloyloxy)ethyltrimethylammonium chloride (METAC), respectively. The effects of ionic strength on brush structure and surface properties of densely grafted polyelectrolyte brushes were analysed by neutron reflectivity (NR) measurements. NR at poly(METAC)/D{sub 2}O and poly(MPC)/D{sub 2}O interface revealed that the grafted polymer chains were fairly extended from the substrate surface, while the thickness reduction of poly(METAC) brush was observed in 5.6 M NaCl/D{sub 2}O solution due to the screening of the repulsive interaction between polycations by hydrated salt ions. Interestingly, no structural change was observed in poly(MPC) brush even in a salt solution probably due to the unique interaction properties of phosphorylcholine units.

Investigation of alkylation and Wittig rearrangement of alkalimetal salts of 9-phenoxyfluorene

International Nuclear Information System (INIS)

Solov'yanov, A.A.; Beletskaya, I.P.; Reutov, O.A.

1985-01-01

The stability of alkai metal (Li + , Na + , K + , Cs + ) salts of 9 phenoxyfluorene to intramolecular transformation in 1.2 dimethoxiethane (DME) is studied, as well as the kinetics of alkylation of these salts by 1-butylbromide. Potassium- and cesium salts are shown to be are stable at 25 deg C. The dissociation constant of a solvate-separated ion par phenoxifluorenylcesium is equal to 4x10 -7 M. The alkylation rate constant free 9-phenoxifluorene carbonione and its cesium salts by 1-butylbromide is 2.9 and 0.057 M -1 xs -1 , respectively

Conflict transformation, stigma, and HIV-preventive structural change.

Science.gov (United States)

Miller, Robin Lin; Reed, Sarah J; Francisco, Vincent T; Ellen, Jonathan M

2012-06-01

Over the prior decade, structural change efforts have become an important component of community-based HIV prevention initiatives. However, these efforts may not succeed when structural change initiatives encounter political resistance or invoke conflicting values, which may be likely when changes are intended to benefit a stigmatized population. The current study sought to examine the impact of target population stigma on the ability of 13 community coalitions to achieve structural change objectives. Results indicated that coalitions working on behalf of highly stigmatized populations had to abandon objectives more often than did coalitions working for less stigmatized populations because of external opposition to coalition objectives and resultant internal conflict over goals. Those coalitions that were most successful in meeting external challenges used opposition and conflict as transformative occasions by targeting conflicts directly and attempting to neutralize oppositional groups or turn them into strategic allies; less successful coalitions working on behalf of stigmatized groups struggled to determine an appropriate response to opposition. The role of conflict transformation as a success strategy for working on behalf of stigmatized groups is discussed.

Salt Tolerance in Soybean

Institute of Scientific and Technical Information of China (English)

Tsui-Hung Phang; Guihua Shao; Hon-Ming Lam

2008-01-01

Soybean is an Important cash crop and its productivity is significantly hampered by salt stress. High salt Imposes negative impacts on growth, nodulation, agronomy traits, seed quality and quantity, and thus reduces the yield of soybean. To cope with salt stress, soybean has developed several tolerance mechanisms, including: (I) maintenance of ion homeostasis; (ii) adjustment in response to osmotic stress; (iii) restoration of osmotic balance; and (iv) other metabolic and structural adaptations. The regulatory network for abiotic stress responses in higher plants has been studied extensively in model plants such as Arabidopsis thaliana. Some homologous components involved in salt stress responses have been identified in soybean. In this review, we tried to integrate the relevant works on soybean and proposes a working model to descdbe Its salt stress responses at the molecular level.

Simulation of Structural Transformations in Heating of Alloy Steel

Science.gov (United States)

Kurkin, A. S.; Makarov, E. L.; Kurkin, A. B.; Rubtsov, D. E.; Rubtsov, M. E.

2017-07-01

Amathematical model for computer simulation of structural transformations in an alloy steel under the conditions of the thermal cycle of multipass welding is presented. The austenitic transformation under the heating and the processes of decomposition of bainite and martensite under repeated heating are considered. Amethod for determining the necessary temperature-time parameters of the model from the chemical composition of the steel is described. Published data are processed and the results used to derive regression models of the temperature ranges and parameters of transformation kinetics of alloy steels. The method developed is used in computer simulation of the process of multipass welding of pipes by the finite-element method.

Elucidating the Solvation Structure and Dynamics of Lithium Polysulfides Resulting from Competitive Salt and Solvent Interactions

Energy Technology Data Exchange (ETDEWEB)

Rajput, Nav Nidhi; Murugesan, Vijayakumar; Shin, Yongwoo; Han, Kee Sung; Lau, Kah Chun; Chen, Junzheng; Liu, Jun; Curtiss, Larry A.; Mueller, Karl T.; Persson, Kristin A.

2017-04-10

Fundamental molecular level understanding of functional properties of liquid solutions provides an important basis for designing optimized electrolytes for numerous applica-tions. In particular, exhaustive knowledge of solvation structure, stability and transport properties is critical for developing stable electrolytes for fast charging and high energy density next-generation energy storage systems. Here we report the correlation between solubility, solvation structure and translational dynamics of a lithium salt (Li-TFSI) and polysulfides species using well-benchmarked classical molecular dynamics simulations combined with nuclear magnetic resonance (NMR). It is observed that the polysulfide chain length has a significant effect on the ion-ion and ion-solvent interaction as well as on the diffusion coefficient of the ionic species in solution. In particular, extensive cluster formation is observed in lower order poly-sulfides (Sx2-; x≤4), whereas the longer polysulfides (Sx2-; x>4) show high solubility and slow dynamics in the solu-tion. It is observed that optimal solvent/salt ratio is essen-tial to control the solubility and conductivity as the addi-tion of Li salt increases the solubility but decreases the mo-bility of the ionic species. This work provides a coupled theoretical and experimental study of bulk solvation struc-ture and transport properties of multi-component electro-lyte systems, yielding design metrics for developing optimal electrolytes with improved stability and solubility.

Stabilization of chromium salt in ordinary portland cement

Indian Academy of Sciences (India)

Ordinary Portland cement (OPC) samples containing the chromium salt have been investigated using differential microcalorimetry, conductometry and Fourier transform infrared spectroscopic analysis. The effect of chromium on OPC hydration was evaluated by continuous observing of early hydration.

Copper Salts Mediated Morphological Transformation of Cu2O from Cubes to Hierarchical Flower-like or Microspheres and Their Supercapacitors Performances

Science.gov (United States)

Chen, Liang; Zhang, Yu; Zhu, Pengli; Zhou, Fengrui; Zeng, Wenjin; Lu, Daoqiang Daniel; Sun, Rong; Wong, Chingping

2015-01-01

Monodisperse Cu2O of different microstructures, such as cubes, flower-like, and microspheres, have been extensively synthesized by a simple polyol reduction method using different copper salts, i.e. (Cu(acac)2, Cu(OH)2, and Cu(Ac)2·H2O). The effects of copper salts on the morphology of Cu2O were investigated in details through various characterization methods, including X-ray diffraction, transmission electron microscopy, scanning electron microscopy and UV-Vis absorption spectra. The effects of morphology on the electrochemical properties were further studied. Among the different structures, Cu2O with the microspheric morphology shows the highest specific capacitance and the best cycling stability compared with those of the other two structures, thus bear larger volume charge during the electrochemical reaction due to the microspheres of small nanoparticles. PMID:25857362

Synthesis of complex oxides with garnet structure by spray drying of an aqueous salt solution

Science.gov (United States)

Makeenko, A. V.; Larionova, T. V.; Klimova-Korsmik, O. G.; Starykh, R. V.; Galkin, V. V.; Tolochko, O. V.

2017-04-01

The use of spray drying to obtain powders of complex oxides with a garnet structure has demonstrated. The processes occurring during heating of the synthesized oxide-salt product, leading to the formation of a material with a garnet structure, have been investigated using DTA, TGA, XPS, and XRD. It has been shown that a single-phase garnet structure of system (Y x Gd(3- x))3Al5O12 can be synthesized over the entire range of compositions.

Relationships of quenching stresses to structural transformations in steel

International Nuclear Information System (INIS)

Loshkarev, V.E.

1985-01-01

Technique for accountancy of the effect of stresses on structural transformations in steel when solving problems of thermoplasticity is suggested. It is revealed on the basis of the conducted calculations that accountancy of interrelation of stressed and structural states of 20Kh2MF steel essentially affects forecasting of results of quenching

Molecular dynamics simulations of the structure and single-particle dynamics of mixtures of divalent salts and ionic liquids

Energy Technology Data Exchange (ETDEWEB)

Gómez-González, Víctor; Docampo-Álvarez, Borja; Gallego, Luis J.; Varela, Luis M., E-mail: luismiguel.varela@usc.es [Grupo de Nanomateriais e Materia Branda, Departamento de Física da Materia Condensada, Universidade de Santiago de Compostela, Campus Vida s/n, E-15782 Santiago de Compostela (Spain); Cabeza, Oscar [Facultade de Ciencias, Universidade da Coruña, Campus A Zapateira s/n, E-15008 A Coruña (Spain); Fedorov, Maxim [Department of Physics, Scottish University Physics Alliance (SUPA), University of Strathclyde, John Anderson Bldg., 107 Rottenrow East, Glasgow G4 0NG (United Kingdom); Lynden-Bell, Ruth M. [Department of Chemistry, University of Cambridge, Lensfield Road, Cambridge CB2 1EW (United Kingdom)

2015-09-28

We report a molecular dynamics study of the structure and single-particle dynamics of mixtures of a protic (ethylammonium nitrate) and an aprotic (1-butyl-3-methylimidazolium hexaflurophosphate [BMIM][PF{sub 6}]) room-temperature ionic liquids doped with magnesium and calcium salts with a common anion at 298.15 K and 1 atm. The solvation of these divalent cations in dense ionic environments is analyzed by means of apparent molar volumes of the mixtures, radial distribution functions, and coordination numbers. For the protic mixtures, the effect of salt concentration on the network of hydrogen bonds is also considered. Moreover, single-particle dynamics of the salt cations is studied by means of their velocity autocorrelation functions and vibrational densities of states, explicitly analyzing the influence of salt concentration, and cation charge and mass on these magnitudes. The effect of the valency of the salt cation on these properties is considered comparing the results with those for the corresponding mixtures with lithium salts. We found that the main structural and dynamic features of the local solvation of divalent cations in ionic liquids are similar to those of monovalent salts, with cations being localized in the polar nanoregions of the bulk mixture coordinated in monodentate and bidentate coordination modes by the [NO{sub 3}]{sup −} and [PF{sub 6}]{sup −} anions. However, stronger electrostatic correlations of these polar nanoregions than in mixtures with salts with monovalent cations are found. The vibrational modes of the ionic liquid (IL) are seen to be scarcely affected by the addition of the salt, and the effect of mass and charge on the vibrational densities of states of the dissolved cations is reported. Cation mass is seen to exert a deeper influence than charge on the low-frequency vibrational spectra, giving a red shift of the vibrational modes and a virtual suppression of the higher energy vibrational modes for the heavier Ca{sup 2

Molecular dynamics simulations of the structure and single-particle dynamics of mixtures of divalent salts and ionic liquids

International Nuclear Information System (INIS)

Gómez-González, Víctor; Docampo-Álvarez, Borja; Gallego, Luis J.; Varela, Luis M.; Cabeza, Oscar; Fedorov, Maxim; Lynden-Bell, Ruth M.

2015-01-01

We report a molecular dynamics study of the structure and single-particle dynamics of mixtures of a protic (ethylammonium nitrate) and an aprotic (1-butyl-3-methylimidazolium hexaflurophosphate [BMIM][PF 6 ]) room-temperature ionic liquids doped with magnesium and calcium salts with a common anion at 298.15 K and 1 atm. The solvation of these divalent cations in dense ionic environments is analyzed by means of apparent molar volumes of the mixtures, radial distribution functions, and coordination numbers. For the protic mixtures, the effect of salt concentration on the network of hydrogen bonds is also considered. Moreover, single-particle dynamics of the salt cations is studied by means of their velocity autocorrelation functions and vibrational densities of states, explicitly analyzing the influence of salt concentration, and cation charge and mass on these magnitudes. The effect of the valency of the salt cation on these properties is considered comparing the results with those for the corresponding mixtures with lithium salts. We found that the main structural and dynamic features of the local solvation of divalent cations in ionic liquids are similar to those of monovalent salts, with cations being localized in the polar nanoregions of the bulk mixture coordinated in monodentate and bidentate coordination modes by the [NO 3 ] − and [PF 6 ] − anions. However, stronger electrostatic correlations of these polar nanoregions than in mixtures with salts with monovalent cations are found. The vibrational modes of the ionic liquid (IL) are seen to be scarcely affected by the addition of the salt, and the effect of mass and charge on the vibrational densities of states of the dissolved cations is reported. Cation mass is seen to exert a deeper influence than charge on the low-frequency vibrational spectra, giving a red shift of the vibrational modes and a virtual suppression of the higher energy vibrational modes for the heavier Ca 2+ cations. No qualitative

Structural and kinetic steps of β→α transformation in titanium

International Nuclear Information System (INIS)

Mirzaev, D.A.; Ul'yanov, V.G.; Shtejnberg, M.M.; Protopopov, V.A.

1981-01-01

α-Ti structure and temperature of β→α transformation within the range of cooling rates from 100 to 5x10 5 deg/sec, is studied. Stepwise temperature decrease of β→α transformation temperature in titanium with the increase of cooling rate is stated. Jump-like drops of transformation temperature observed in the case of increasing critical cooling rates, are followed by change of α-phase morphology [ru

Nonlocal transformation of the internal quantum particle structure

Directory of Open Access Journals (Sweden)

Alexey Yu. Samarin

2016-09-01

Full Text Available The analysis of the integral wave equation, having path integral kernel, has resulted, that collapse phenomenon is based on the nonlocal transformation of the internal structure of a quantum particle, considering in the form of the matter fields collection. This nonlocality allows to escape the contradiction between the reduction quantum mechanics postulate and special relativity. It is shown, that the wave function transformation, corresponding to von Neumann's reduction, has the deterministic nature and the quantum mechanics stochasticity is a consequence of a macroscopic measurer presence in the measuring process. Besides it is demonstrated, that the decogerence phenomenon has the same mechanism of the wave function transformation. EPR-type experiment is described in detail and the possibility of the faster-then light communication is proved, as well the possible rules of thumb of this communication are proposed.

Dynamic transformation of self-assembled structures using anisotropic magnetized hydrogel microparticles

Science.gov (United States)

Yoshida, Satoru; Takinoue, Masahiro; Iwase, Eiji; Onoe, Hiroaki

2016-08-01

This paper describes a system through which the self-assembly of anisotropic hydrogel microparticles is achieved, which also enables dynamic transformation of the assembled structures. Using a centrifuge-based microfluidic device, anisotropic hydrogel microparticles encapsulating superparamagnetic materials on one side are fabricated, which respond to a magnetic field. We successfully achieve dynamic assembly using these hydrogel microparticles and realize three different self-assembled structures (single and double pearl chain structures, and close-packed structures), which can be transformed to other structures dynamically via tuning of the precessional magnetic field. We believe that the developed system has potential application as an effective platform for a dynamic cell manipulation and cultivation system, in biomimetic autonomous microrobot organization, and that it can facilitate further understanding of the self-organization and complex systems observed in nature.

Structural analysis and martensitic transformation in equiatomic HfPd alloy

Science.gov (United States)

Hisada, S.; Matsuda, M.; Takashima, K.; Yamabe-Mitarai, Y.

2018-02-01

We investigated the crystal structure and the martensitic transformation in equiatomic HfPd alloy. The analysis of the crystal structure by electron diffraction and Rietveld refinement using X-ray diffraction data indicates that the space group of the martensitic phase is Cmcm, and the lattice parameters are a = 0.329 nm, b = 1.021 nm, and c = 0.438 nm. Martensitic variants are composed of the plate-like morphology of several hundred nm, and the boundaries between the variants have (021)Cmcm twin relations. This (021)Cmcm twin boundary seems to be sharp without ledge and steps. Differential scanning calorimetry measurement indicates that each martensitic transformation temperature is determined to be Ms = 819 K, Mf = 794 K, As = 928 K, and Af = 954 K. Based on the dimension change using a thermo-mechanical analyzer, the expansion and shrinkage of the sample occurred with the forward and reverse martensitic transformation, respectively.

Non-isothermal kinetics of phase transformations in magnetron sputtered alumina films with metastable structure

International Nuclear Information System (INIS)

Zuzjaková, Š.; Zeman, P.; Kos, Š.

2013-01-01

Highlights: • Non-isothermal kinetics of phase transformations in alumina films was investigated. • The structure of alumina films affects kinetics of the transformation processes. • Kinetic triplets of all transformation processes were determined. • The KAS, FWO, FR and IKP methods for determination of E a and A were used. • The Málek method for determination of the kinetic model was used. - Abstract: The paper reports on non-isothermal kinetics of transformation processes in magnetron sputtered alumina thin films with an amorphous and γ-phase structure leading ultimately to the formation of the thermodynamically stable α-Al 2 O 3 phase. Phase transformation sequences in the alumina films were investigated using differential scanning calorimetry (DSC) at four different heating rates (10, 20, 30, 40 °C/min). Three isoconversional methods (Kissinger–Akahira–Sunose (KAS), Flynn–Wall–Ozawa (FWO) and Friedman (FR) method) as well as the invariant kinetic parameters (IKP) method were used to determine the activation energies for transformation processes. Moreover, the pre-exponential factors were determined using the IKP method. The kinetic models of the transformation processes were determined using the Málek method. It was found that the as-deposited structure of alumina films affects kinetics of the transformation processes. The film with the amorphous as-deposited structure heated at 40 °C/min transforms to the crystalline γ phase at a temperature of ∼930 °C (E a,IKP = 463 ± 10 kJ/mol) and subsequently to the crystalline α phase at a temperature of ∼1200 °C (E a,IKP = 589 ± 10 kJ/mol). The film with the crystalline γ-phase structure heated at 40 °C/min is thermally stable up to ∼1100 °C and transforms to the crystalline α phase (E a,IKP = 511 ± 16 kJ/mol) at a temperature of ∼1195 °C. The empirical two-parameter Šesták–Berggren kinetic model was found to be the most adequate one to describe all transformation processes

Salt bridge as a gatekeeper against partial unfolding.

Science.gov (United States)

Hinzman, Mark W; Essex, Morgan E; Park, Chiwook

2016-05-01

Salt bridges are frequently observed in protein structures. Because the energetic contribution of salt bridges is strongly dependent on the environmental context, salt bridges are believed to contribute to the structural specificity rather than the stability. To test the role of salt bridges in enhancing structural specificity, we investigated the contribution of a salt bridge to the energetics of native-state partial unfolding in a cysteine-free version of Escherichia coli ribonuclease H (RNase H*). Thermolysin cleaves a protruding loop of RNase H(*) through transient partial unfolding under native conditions. Lys86 and Asp108 in RNase H(*) form a partially buried salt bridge that tethers the protruding loop. Investigation of the global stability of K86Q/D108N RNase H(*) showed that the salt bridge does not significantly contribute to the global stability. However, K86Q/D108N RNase H(*) is greatly more susceptible to proteolysis by thermolysin than wild-type RNase H(*) is. The free energy for partial unfolding determined by native-state proteolysis indicates that the salt bridge significantly increases the energy for partial unfolding by destabilizing the partially unfolded form. Double mutant cycles with single and double mutations of the salt bridge suggest that the partially unfolded form is destabilized due to a significant decrease in the interaction energy between Lys86 and Asp108 upon partial unfolding. This study demonstrates that, even in the case that a salt bridge does not contribute to the global stability, the salt bridge may function as a gatekeeper against partial unfolding that disturbs the optimal geometry of the salt bridge. © 2016 The Protein Society.

Thermal induced structural transformation of bimetallic AuPd nanoparticles

International Nuclear Information System (INIS)

Bruma, A; Li, Z Y

2014-01-01

High Angle Annular Dark Field Scanning Transmission Electron Microscope (HAADF-STEM) has been employed for the study of thermal effects of structural transformation of AuPd nanoparticles produced by physical vapour deposition. Depending on the duration of annealing at a temperature of 500 K, atomic resolved imaging analysis reveals the formation of various structure morphologies from the ordered L1 2 superlattice to the core-shell structure. The effects of Pd-oxides are also discussed

Using the characteristics of the structure of the upper Frasnian salt bearing formation in prospecting for oil deposits in the Pripyat depression

Energy Technology Data Exchange (ETDEWEB)

Yeroshina, D.M.; Kislik, V.Z.; Sinichka, A.M.; Vysotskiy, E.A.

1984-01-01

The possibility is shown of using the structure of the upper Frasnian salt bearing formation to establish ancient depressions and uplifts. A gradual wedge out of the lower strata of rock salt towards the domes of the ancient uplifts occurs. It is recommended that several reflecting levels be built up in the base of the salt bearing formation to record the behavior of these strata.

Response of Soil Fungi Community Structure to Salt Vegetation Succession in the Yellow River Delta.

Science.gov (United States)

Wang, Yan-Yun; Guo, Du-Fa

2016-10-01

High-throughput sequencing technology was used to reveal the composition and distribution of fungal community structure in the Yellow River Delta under bare land and four kinds of halophyte vegetation (saline seepweed, Angiospermae, Imperata and Apocynum venetum [A. venetum]). The results showed that the soil quality continuously improved with the succession of salt vegetation types. The soil fungi richness of mild-salt communities (Imperata and A. venetum) was relatively higher, with Shannon index values of 5.21 and 5.84, respectively. The soil fungi richness of severe-salt-tolerant communities (saline seepweed, Angiospermae) was relatively lower, with Shannon index values of 4.64 and 4.66, respectively. The UniFrac metric values ranged from 0.48 to 0.67 when the vegetation was in different succession stages. A total of 60,174 valid sequences were obtained for the five vegetation types, and they were classified into Ascomycota, Basidiomycota, Chytridiomycota, Glomeromycota and Mucoromycotina. Ascomycota had the greatest advantage among plant communities of Imperata and A. venetum, as indicated by relative abundances of 2.69 and 69.97 %, respectively. Basidiomycota had the greatest advantage among mild-salt communities of saline seepweed and Angiospermae, with relative abundances of 9.43 and 6.64 %, respectively. Soil physical and chemical properties were correlated with the distribution of the fungi, and Mucor was significantly correlated with soil moisture (r = 0.985; P Soil quality, salt vegetation and soil fungi were influenced by each other.

From Virtual Organization to E-Business: Transformational Structuration

OpenAIRE

James J. Lee; Bandula Jayatilaka; Ben B. Kim; Ted E. Lee; Pairin Katerattanakul; Soongoo Hong

2010-01-01

This article shows how the technical hype of 1990s has been transformed into the e-business organizations at the beginning of the 21st century. The authors took an interpretive stance in this study, grounded theory, and investigated the ontology of virtual organization by the metaphorical analysis. The metaphorical analysis adopted in this study provides the analytical power to conceptualize the social structure of virtual organization in the context of structuration theory with the process o...

Superconductivity of Rock-Salt Structure LaO Epitaxial Thin Film.

Science.gov (United States)

Kaminaga, Kenichi; Oka, Daichi; Hasegawa, Tetsuya; Fukumura, Tomoteru

2018-06-06

We report a superconducting transition in a LaO epitaxial thin film with the superconducting transition onset temperature ( T c ) at around 5 K. This T c is higher than those of other lanthanum monochalcogenides and opposite to their chemical trend: T c = 0.84, 1.02, and 1.48 K for LaX (X = S, Se, Te), respectively. The carrier control resulted in a dome-shaped T c as a function of electron carrier density. In addition, the T c was significantly sensitive to epitaxial strain in spite of the highly symmetric crystal structure. This rock-salt superconducting LaO could be a building block to design novel superlattice superconductors.

The social structural foundations of adaptation and transformation in social-ecological systems

Directory of Open Access Journals (Sweden)

Michele L. Barnes

2017-12-01

Full Text Available Social networks are frequently cited as vital for facilitating successful adaptation and transformation in linked social-ecological systems to overcome pressing resource management challenges. Yet confusion remains over the precise nature of adaptation vs. transformation and the specific social network structures that facilitate these processes. Here, we adopt a network perspective to theorize a continuum of structural capacities in social-ecological systems that set the stage for effective adaptation and transformation. We begin by drawing on the resilience literature and the multilayered action situation to link processes of change in social-ecological systems to decision making across multiple layers of rules underpinning societal organization. We then present a framework that hypothesizes seven specific social-ecological network configurations that lay the structural foundation necessary for facilitating adaptation and transformation, given the type and magnitude of human action required. A key contribution of the framework is explicit consideration of how social networks relate to ecological structures and the particular environmental problem at hand. Of the seven configurations identified, three are linked to capacities conducive to adaptation and three to transformation, and one is hypothesized to be important for facilitating both processes. We discuss how our theoretical framework can be applied in practice by highlighting existing empirical examples from related environmental governance contexts. Further extension of our hypotheses, particularly as more data become available, can ultimately help guide the design of institutional arrangements to be more effective at dealing with change.

Structural transformations of heat-treated bacterial iron oxide

Energy Technology Data Exchange (ETDEWEB)

Hashimoto, Hideki, E-mail: hideki-h@cc.okayama-u.ac.jp [Graduate School of Natural Science and Technology, Okayama University, Okayama 700-8530 (Japan); JST, CREST, Okayama 700-8530 (Japan); Fujii, Tatsuo [Graduate School of Natural Science and Technology, Okayama University, Okayama 700-8530 (Japan); Kohara, Shinji [Japan Synchrotron Radiation Research Institute, Sayo, Hyogo 679-5198 (Japan); Nakanishi, Koji [Office of Society-Academia Collaboration for Innovation, Kyoto University, Uji 611-0011 (Japan); Yogi, Chihiro [SR Center, Ritsumeikan University, Kusatsu, Shiga 525-8577 (Japan); Peterlik, Herwig [Faculty of Physics, University of Vienna, A-1090 Vienna (Austria); Nakanishi, Makoto [Graduate School of Natural Science and Technology, Okayama University, Okayama 700-8530 (Japan); Takada, Jun [Graduate School of Natural Science and Technology, Okayama University, Okayama 700-8530 (Japan); JST, CREST, Okayama 700-8530 (Japan)

2015-04-01

A bacterial siliceous iron oxide microtubule (diameter: ca. 1 μm, 15Fe{sub 2}O{sub 3}·8SiO{sub 2}·P{sub 2}O{sub 5}·30H{sub 2}O) produced by Leptothrix ochracea was heat treated in air and its structural transformation was investigated in detail by microscopy, diffractometry, and spectroscopy. Although the heat-treated bacterial iron oxide retained its original microtubular structure, its nanoscopic, middle-range, and local structures changed drastically. Upon heat treatment, nanosized pores were formed and their size changed depending on temperature. The Fe–O–Si linkages were gradually cleaved with increasing temperature, causing the progressive separation of Fe and Si ions into iron oxide and amorphous silicate phases, respectively. Concomitantly, global connectivity and local structure of FeO{sub 6} octahedra in the iron oxide nanoparticles systematically changed depending on temperature. These comprehensive investigations clearly revealed various structural changes of the bacterial iron oxide which is an important guideline for the future exploration of novel bio-inspired materials. - Highlights: • Structural transformation of a bacterial iron oxide microtubule was investigated. • Si–O–Fe was cleaved with increasing temperature to form α-Fe{sub 2}O{sub 3}/silicate composite. • Crystallization to 2Fh started at 500 °C to give α-Fe{sub 2}O{sub 3} >700 °C. • FeO{sub 6} octahedra were highly distorted <500 °C. • Formation of face-sharing FeO{sub 6} was promoted >500 °C, releasing the local strain of FeO{sub 6}.

Cu(ii)-catalyzed sulfide construction: both aryl groups utilization of intermolecular and intramolecular diaryliodonium salt.

Science.gov (United States)

Wang, Ming; Wei, Jianpeng; Fan, Qiaoling; Jiang, Xuefeng

2017-03-07

A sulfur-iodine exchange protocol of diaryliodonium salts with inorganic sulfur salt was developed. Both aryl groups in the diaryliodonium salt were fully exerted in this transformation. Five- to eight-membered sulfur-containing heterocycles were achieved. Note that [1]benzothieno-[3,2-b][1]benzothiophene (BTBT) (an organic field-effect transistor (OFET) material) and Zaltoprofen were efficiently established through this method.

Crystal structure of bile salt hydrolase from Lactobacillus salivarius.

Science.gov (United States)

Xu, Fuzhou; Guo, Fangfang; Hu, Xiao Jian; Lin, Jun

2016-05-01

Bile salt hydrolase (BSH) is a gut-bacterial enzyme that negatively influences host fat digestion and energy harvesting. The BSH enzyme activity functions as a gateway reaction in the small intestine by the deconjugation of glycine-conjugated or taurine-conjugated bile acids. Extensive gut-microbiota studies have suggested that BSH is a key mechanistic microbiome target for the development of novel non-antibiotic food additives to improve animal feed production and for the design of new measures to control obesity in humans. However, research on BSH is still in its infancy, particularly in terms of the structural basis of BSH function, which has hampered the development of BSH-based strategies for improving human and animal health. As an initial step towards the structure-function analysis of BSH, C-terminally His-tagged BSH from Lactobacillus salivarius NRRL B-30514 was crystallized in this study. The 1.90 Å resolution crystal structure of L. salivarius BSH was determined by molecular replacement using the structure of Clostridium perfringens BSH as a starting model. It revealed this BSH to be a member of the N-terminal nucleophile hydrolase superfamily. Crystals of apo BSH belonged to space group P21212, with unit-cell parameters a = 90.79, b = 87.35, c = 86.76 Å (PDB entry 5hke). Two BSH molecules packed perfectly as a dimer in one asymmetric unit. Comparative structural analysis of L. salivarius BSH also identified potential residues that contribute to catalysis and substrate specificity.

AMS fabric and structural record along a strain gradient in an extrusive salt diapir (Kuh-e-Namak, Dashti, Iran)

Science.gov (United States)

Zavada, Prokop; Schulmann, Karel; Lexa, Ondrej; Machek, Matej; Roxerova, Zuzana; Kusbach, Vladimir

2016-04-01

The AMS record and the halite fabrics on meso- and micro-scale were studied in detail on a well exposed salt extrusive body in Iran. In the Kuh-e-Namak (Dashti) mountain salt diapir, the deformation structures in colored salt are displayed along longitudinal profiles across the dome and two glaciers that extend from the NE and SW edge of the dome. The profiles from the dome to the frontal parts of the glaciers reveal a continuous strain gradient associated with transposition of the domal salt fabrics by axial fold cleavage development during flow of rock salt over the ridges in the channel. The extruded salt belongs to the Hormuz sequence of Neo-Proterozoic to Early Cambrian age. From central dome towards especially the northern namakier, structural record revealed zonation from; 1) gravitational collapse related recumbent isoclinal folds in the dome, 2) flat normal shears at the edge of the dome, 3) collapsed vertical layering into flat lying transpositional fabric at the toe of the dome, 4) penetrative fold cleavage transposition of earlier fabrics above the topographical ridge in the base of the flow, locally displaying strong transversal constrictional fabrics, 5) banded mylonites with isoclinal rootless folds in subhorizontally banded frontal and marginal domain of the glacier. The AMS fabric in the rock salt is generated primarily by hematite dispersed in the recrystallized halite. The AMS exhibits three main types of fabric symmetry from clustered all directions (K1,K2,K3, orthogonal fabric) to clustered K1 directions with girdle forming K2,K3 axes and clustered K3 directions with girdle of K1 and K2 directions. The AMS fabric clearly reflects the macroscopic fabric transpositions along the entire investigated strain gradient in the rock salt. Magnetic fabrics reveal continuous trends from bimodal to semi-girdle distribution of foliations in folded and cleavage present regions, to magnetic lineation clustering perpendicular to flow in completely refolded

Effect of hydrated salts on the microstructure and phase transformation of poly(vinylidenefluoride-hexafluoropropylene) composites

Science.gov (United States)

Yuennan, Jureeporn; Sukwisute, Pisan; Muensit, Nantakan

2018-05-01

The present work has investigated a means of fabricating porous, β phase P(VDF-HFP) film by adding two kinds of hydrated metal salts. Without the use of mechanical stretching or electrical poling treatments, MgCl2 · 6H2O and AlCl3 · 6H2O are found to induce the formation of β phase crystals in porous film derived from the solution casting method. Trivalent Al ions have been found to effectively promote the self-oriented β phase of the P(VDF-HFP) film greater than divalent Mg ions. The overall β content is achieved about 38% and 42% for adding 0.25 wt% Mg- and Al-salts, respectively. The average pore sizes and surface roughness of porous P(VDF-HFP) films are increased with increasing salt concentration. The dielectric constant of about 5 for pure P(VDF-HFP) film (at 100 Hz) has been boosted up to 13–19 when adding the salts. In addition, the P(VDF-HFP) films filled with Al-salt exhibit the largest piezoelectric coefficient of 20 pC/N. Thus, the modified polymers are one of candidate materials for using in dielectric and piezoelectric applications.

Research opportunities in salt hydrates for thermal energy storage

Science.gov (United States)

Braunstein, J.

1983-11-01

The state of the art of salt hydrates as phase change materials for low temperature thermal energy storage is reviewed. Phase equilibria, nucleation behavior and melting kinetics of the commonly used hydrate are summarized. The development of efficient, reliable inexpensive systems based on phase change materials, especially salt hydrates for the storage (and retrieval) of thermal energy for residential heating is outlined. The use of phase change material thermal energy storage systems is not yet widespread. Additional basic research is needed in the areas of crystallization and melting kinetics, prediction of phase behavior in ternary systems, thermal diffusion in salt hydrate systems, and in the physical properties pertinent to nonequilibrium and equilibrium transformations in these systems.

Imaging of salt structure. 2; Gan`enso kozo no imaging. 2

Energy Technology Data Exchange (ETDEWEB)

Akama, K; Saeki, T [Japan National Oil Corp., Tokyo (Japan). Technology Research Center; Matsuoka, T [Japan Petroleum Exploration Corp., Tokyo (Japan)

1997-05-27

With respect to a velocity model structuring method using depth focusing analysis (DFA) as a depth image processing technology used for elastic wave exploration, its practicability was discussed. First, synthetic data were used to extract problems in the DFA. The problems were extracted by using a model with constant velocity as an initial model, deciding on the sequential structures from the higher order, and estimating velocity and depth of each layer by using a model fitting type method. In its application to field data, characteristic records include those for rock salt beds distributed in a sheet form and the folding structure associated with the growth thereof, as acquired in offshore seismic exploration carried out in the eastern part of Gulf of Mexico. The conclusion is that the DFA is a method that can derive a velocity model with required accuracy by using a minimum number of repetition even against relatively complex structures. Particularly, the quick convergence from the initial model with a constant velocity until a certain accuracy is reached is a noteworthy advantage. 3 refs., 6 figs.

Diclofenac Salts. V. Examples of Polymorphism among Diclofenac Salts with Alkyl-hydroxy Amines Studied by DSC and HSM

Directory of Open Access Journals (Sweden)

Adamo Fini

2010-04-01

Full Text Available Nine diclofenac salts prepared with alkyl-hydroxy amines were analyzed for their properties to form polymorphs by DSC and HSM techniques. Thermograms of the forms prepared from water or acetone are different in most cases, suggesting frequent examples of polymorphism among these salts. Polymorph transition can be better highlighted when analysis is carried out by thermo-microscopy, which in most cases made it possible to observe the processes of melting of the metastable form and re-crystallization of the stable one. Solubility values were qualitatively related to the crystal structure of the salts and the molecular structure of the cation.

The Innovative Structure Solution for Preventing Salt Intrusion and Retaining Freshwater In Mekong Delta VietNam

NARCIS (Netherlands)

Hong, S.T.; Vrijling, J.K.; Stive, M.J.F.

2013-01-01

In the Mekong Delta Vietnam, the construction of sluices with the purpose of retaining fresh water and preventing salt water intrusion potentially plays a very important role. However, the structures constructed in small rivers according to local or traditional technology revealed many disadvantages

Structural transformation and its relevance for economic growth in sub-Saharan Africa

OpenAIRE

Busse, Matthias; Erdogan, Ceren; Mühlen, Henning

2017-01-01

In this paper, we analyse the role of structural transformation in view of the remarkable growth performance of sub-Saharan African countries since the mid-1990s. Our analysis covers 41 African countries over the period 1980 to 2014 and accounts for structural transformation by employing the analytical frameworks of (1) growth decomposition and (2) growth regression. Even though the low-productive agricultural sector continues to employ most of the African workforce, our results reveal that s...

Molten salt corrosion behavior of structural materials in LiCl-KCl-UCl3 by thermogravimetric study

Science.gov (United States)

Rao, Ch Jagadeeswara; Ningshen, S.; Mallika, C.; Mudali, U. Kamachi

2018-04-01

The corrosion resistance of structural materials has been recognized as a key issue in the various unit operations such as salt purification, electrorefining, cathode processing and injection casting in the pyrochemical reprocessing of spent metallic nuclear fuels. In the present work, the corrosion behavior of the candidate materials of stainless steel (SS) 410, 2.25Cr-1Mo and 9Cr-1Mo steels was investigated in molten LiCl-KCl-UCl3 salt by thermogravimetric analysis under inert and reactive atmospheres at 500 and 600 °C, for 6 h duration. Insignificant weight gain (less than 1 mg/cm2) in the inert atmosphere and marginal weight gain (maximum 5 mg/cm2) in the reactive atmosphere were observed at both the temperatures. Chromium depletion rates and formation of Cr-rich corrosion products increased with increasing temperature of exposure in both inert and reactive atmospheres as evidenced by SEM and EDS analysis. The corrosion attack by LiCl-KCl-UCl3 molten salt, under reactive atmosphere for 6 h duration was more in the case of SS410 than 9Cr-1Mo steel followed by 2.25Cr-1Mo steel at 500 °C and the corrosion attack at 600 °C followed the order: 9Cr-1Mo steel >2.25Cr-1Mo steel > SS410. Outward diffusion of the minor alloying element, Mo was observed in 9Cr-1Mo and 2.25Cr-1Mo steels at both temperatures under reactive atmosphere. Laser Raman spectral analysis of the molten salt corrosion tested alloys under a reactive atmosphere at 500 and 600 °C for 6 h revealed the formation of unprotected Fe3O4 and α-as well as γ-Fe2O3. The results of the present study facilitate the selection of structural materials for applications in the corrosive molten salt environment at high temperatures.

Structure based classification for bile salt export pump (BSEP) inhibitors using comparative structural modeling of human BSEP

Science.gov (United States)

Jain, Sankalp; Grandits, Melanie; Richter, Lars; Ecker, Gerhard F.

2017-06-01

The bile salt export pump (BSEP) actively transports conjugated monovalent bile acids from the hepatocytes into the bile. This facilitates the formation of micelles and promotes digestion and absorption of dietary fat. Inhibition of BSEP leads to decreased bile flow and accumulation of cytotoxic bile salts in the liver. A number of compounds have been identified to interact with BSEP, which results in drug-induced cholestasis or liver injury. Therefore, in silico approaches for flagging compounds as potential BSEP inhibitors would be of high value in the early stage of the drug discovery pipeline. Up to now, due to the lack of a high-resolution X-ray structure of BSEP, in silico based identification of BSEP inhibitors focused on ligand-based approaches. In this study, we provide a homology model for BSEP, developed using the corrected mouse P-glycoprotein structure (PDB ID: 4M1M). Subsequently, the model was used for docking-based classification of a set of 1212 compounds (405 BSEP inhibitors, 807 non-inhibitors). Using the scoring function ChemScore, a prediction accuracy of 81% on the training set and 73% on two external test sets could be obtained. In addition, the applicability domain of the models was assessed based on Euclidean distance. Further, analysis of the protein-ligand interaction fingerprints revealed certain functional group-amino acid residue interactions that could play a key role for ligand binding. Though ligand-based models, due to their high speed and accuracy, remain the method of choice for classification of BSEP inhibitors, structure-assisted docking models demonstrate reasonably good prediction accuracies while additionally providing information about putative protein-ligand interactions.

Promoting structural transformation: Strategic diversification vs laissez-faire approach

NARCIS (Netherlands)

Freire Junior, Clovis

2017-01-01

Economic development is associated with structural transformation and the increase of complexity of production and exports. This paper examines whether strategic diversification is required to increase economic complexity or whether market incentives would be sufficient to drive this process of

Coproduction as a structural transformation of the public sector

NARCIS (Netherlands)

Meijer, Albert

2016-01-01

Purpose: Coproduction fundamentally changes the roles of citizens and governments. The purpose of this paper is to enhance the theoretical understanding of the transformative changes in the structural order of the public domain that result from the coproduction of public services.

Local structure information by EXAFS analysis using two algorithms for Fourier transform calculation

International Nuclear Information System (INIS)

Aldea, N; Pintea, S; Rednic, V; Matei, F; Hu Tiandou; Xie Yaning

2009-01-01

The present work is a comparison study between different algorithms of Fourier transform for obtaining very accurate local structure results using Extended X-ray Absorption Fine Structure technique. In this paper we focus on the local structural characteristics of supported nickel catalysts and Fe 3 O 4 core-shell nanocomposites. The radial distribution function could be efficiently calculated by the fast Fourier transform when the coordination shells are well separated while the Filon quadrature gave remarkable results for close-shell coordination.

Copper coordination polymers constructed from thiazole-5-carboxylic acid: Synthesis, crystal structures, and structural transformation

Energy Technology Data Exchange (ETDEWEB)

Meundaeng, Natthaya; Rujiwatra, Apinpus [Department of Chemistry, Faculty of Science, Chiang Mai University, Chiang Mai 50200 (Thailand); Prior, Timothy J., E-mail: t.prior@hull.ac.uk [Chemistry, University of Hull, Kingston upon Hull HU6 7RX (United Kingdom)

2017-01-15

We have successfully prepared crystals of thiazole-5-carboxylic acid (5-Htza) (L) and three new thiazole-5-carboxylate-based Cu{sup 2+} coordination polymers with different dimensionality, namely, 1D [Cu{sub 2}(5-tza){sub 2}(1,10-phenanthroline){sub 2}(NO{sub 3}){sub 2}] (1), 2D [Cu(5-tza){sub 2}(MeOH){sub 2}] (2), and 3D [Cu(5-tza){sub 2}]·H{sub 2}O (3). These have been characterized by single crystal X-ray diffraction and thermogravimetry. Interestingly, the 2D network structure of 2 can directly transform into the 3D framework of 3 upon removal of methanol molecules at room temperature. 2 can also undergo structural transformation to produce the same 2D network present in the known [Cu(5-tza){sub 2}]·1.5H{sub 2}O upon heat treatment for 2 h. This 2D network can adsorb water and convert to 3 upon exposure to air. - Highlights: • Rare examples of coordination polymers of thiazole-5-carboxylic acid were prepared. • Non-covalent interactions play a key role on the assembly of the complexes in solid state. • Structural transformation of a 2D framework to a 3D upon removal of methanol is observed.

HIRING TRANSFORMATIONAL LEADERS IN EDUCATION: LESSONS LEARNED FROM STRUCTURED EMPLOYMENT INTERVIEWS

Directory of Open Access Journals (Sweden)

Denver Jade Fowler

2016-09-01

Full Text Available In the educational setting, hiring transformational leaders is essential to a schools’ success or failure. In this study, we examine Confucianism and country influence on structured employment interviews from both Western (United States and Eastern cultures (Taiwan. Eastern cultures have certain values not prevalent in Western cultures that may reduce the use of transformational leadership questions in job interviews. Eastern cultures have higher levels of uncertainty avoidance, collectivism, and power distance. We examined questions asked in actual job interviews in Taiwan and the United States (N = 178. Additionally, we examined the three dimensions of interview structure including evaluation standardization, question sophistication, and questioning consistency. We found that the number of questions about transformational leadership were less common in Taiwan, with its lower selection ratios, and when question sophistication and consistency were higher. In the United States, we found that the number of questions about transformational leadership increased with selection ratio, question sophistication, and question consistency, but not in Taiwan. The results of this study have important implications to all workplace settings around the globe where it may be argued that it is advantageous to hire transformational leaders to improve any organization. However, the results of this study may have particular importance to the educational setting, in both China and the United States, and globally, where the need to attract and hire transformational leaders can be vital to a schools’ success (or failure.

Thermodynamics and structure of inclusion compounds of tauro- and glyco-conjugated bile salts and beta-cyclodextrin

DEFF Research Database (Denmark)

Holm, Rene; Shi, Wei; Andersen Hartvig, Rune

2009-01-01

The interaction between natural beta-cyclodextrin and bile salts common in rat, dog and man, taurocholate, tauro-beta-muricholate, taurodeoxycholate, taurochenodeoxycholate, glycocholate, glycodeoxycholate and glycochenodeoxycholate, was studied using isothermal titration calorimetry, and the str......The interaction between natural beta-cyclodextrin and bile salts common in rat, dog and man, taurocholate, tauro-beta-muricholate, taurodeoxycholate, taurochenodeoxycholate, glycocholate, glycodeoxycholate and glycochenodeoxycholate, was studied using isothermal titration calorimetry......, and the structural differences in the interaction were investigated by H-1-ROESY NMR and molecular modeling. The beta-cyclodextrin was selected based upon its frequent use in preformulation and drug formulation as oral excipients for the solubilization of drug substances with low aqueous solubility. All...

Molten salt reactor type

International Nuclear Information System (INIS)

1977-01-01

This document is one of the three parts of a first volume devoted to the compilations of American data on the molten salt reactor concept. Emphasize is put essentially on the fuel salt of the primary circuit inside which fission reactions occur. The reasons why the (LiF-BeF 2 -ThF 4 -UF 4 ) salt was chosen for the M.S.B.R. concept are examined; the physical, physicochemical and chemical properties of this salt are discussed with its interactions with the structural materials and its evolution in time. An important part of this volume is devoted to the continuous reprocessing of the active salt, the project designers having deemed advisable to take advantage at best from the availability of a continuous purification, in a thermal breeding. The problem of tritium formation and distribution inside the reactor is also envisaged and the fundamentals of the chemistry of the secondary coolant salt are given. The solutions proposed are: the hydrogen scavenging of the primary circuit, a reduction in metal permeability by an oxyde layer deposition on the side in contact with the vapor, and tritium absorption through an isotope exchange with the hydroxifluoroborate [fr

Habitat structure modified by an invasive grass enhances inundation withstanding in a salt-marsh wolf spider

OpenAIRE

Pétillon, J.; Lambeets, K.; Montaigne, W.; Maelfait, J.-P.; Bonte, D.

2010-01-01

Vegetation and underground structures are known to influence flood avoidance and flood resistance in invertebrates. In bimonthly-flooded European salt marshes, recent invasions by the nitrophilous grass Elymus athericus strongly modified usual habitat structure, notably by the production of a deep litter layer. Consequently, invaded habitats provide more interstitial spaces that may act as a refuge during flood events. By using both controlled and field designs, we tested whether invaded habi...

Internal deformation in layered Zechstein-III K-Mg salts. Structures formed by complex deformation and high contrasts in viscosity observed in drill cores.

Science.gov (United States)

Raith, Alexander; Urai, Janos L.

2016-04-01

During the evaporation of a massive salt body, alternations of interrupted and full evaporation sequences can form a complex layering of different lithologies. Viscosity contrasts of up to five orders of magnitude between these different lithologies are possible in this environment. During the late stage of an evaporation cycle potassium and magnesium (K-Mg) salts are precipitated. These K-Mg salts are of economic interest but also a known drilling hazard due to their very low viscosity. How up to 200m thick layers of these evaporites affect salt deformation at different scales is not well known. A better understanding of salt tectonics with extreme mechanical stratification is needed for better exploration and production of potassium-magnesium salts and to predict the internal structure of potential nuclear waste repositories in salt. To gain a better understanding of the internal deformation of these layers we analyzed K-Mg salt rich drill cores out of the Zechstein III-1b subunit from the Veendam Pillow 10 km southeast of Groningen, near the city Veendam in the NE Netherlands. The study area has a complex geological history with multiple tectonic phases of extension and compression forming internal deformation in the pillow but also conserving most of the original layering. Beside halite the most common minerals in the ZIII-1b are carnallite, kieserite, anhydrite and bischofite alternating in thin layers of simple composition. Seismic interpretation revealed that the internal structure of the Veendam Pillow shows areas, in which the K-Mg salt rich ZIII 1b layer is much thicker than elsewhere, as a result of salt deformation. The internal structure of the ZIII-1b on the other hand, remains unknown. The core analysis shows a strong strain concentration in the weaker Bischofite (MgCl2*6H20) and Carnallite (KMgCl3*6H20) rich layers producing tectonic breccias and highly strained layers completely overprinting the original layering. Layers formed by alternating beds

Electronic Structure of the Metastable Epitaxial Rock-Salt SnSe {111} Topological Crystalline Insulator

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Wencan Jin

2017-10-01

Full Text Available Topological crystalline insulators have been recently predicted and observed in rock-salt structure SnSe {111} thin films. Previous studies have suggested that the Se-terminated surface of this thin film with hydrogen passivation has a reduced surface energy and is thus a preferred configuration. In this paper, synchrotron-based angle-resolved photoemission spectroscopy, along with density functional theory calculations, is used to demonstrate that a rock-salt SnSe {111} thin film epitaxially grown on Bi_{2}Se_{3} has a stable Sn-terminated surface. These observations are supported by low-energy electron diffraction (LEED intensity-voltage measurements and dynamical LEED calculations, which further show that the Sn-terminated SnSe {111} thin film has undergone a surface structural relaxation of the interlayer spacing between the Sn and Se atomic planes. In sharp contrast to the Se-terminated counterpart, the observed Dirac surface state in the Sn-terminated SnSe {111} thin film is shown to yield a high Fermi velocity, 0.50×10^{6}  m/s, which suggests a potential mechanism of engineering the Dirac surface state of topological materials by tuning the surface configuration.

The Box-Cox power transformation on nursing sensitive indicators: does it matter if structural effects are omitted during the estimation of the transformation parameter?

Science.gov (United States)

Hou, Qingjiang; Mahnken, Jonathan D; Gajewski, Byron J; Dunton, Nancy

2011-08-19

Many nursing and health related research studies have continuous outcome measures that are inherently non-normal in distribution. The Box-Cox transformation provides a powerful tool for developing a parsimonious model for data representation and interpretation when the distribution of the dependent variable, or outcome measure, of interest deviates from the normal distribution. The objectives of this study was to contrast the effect of obtaining the Box-Cox power transformation parameter and subsequent analysis of variance with or without a priori knowledge of predictor variables under the classic linear or linear mixed model settings. Simulation data from a 3 × 4 factorial treatments design, along with the Patient Falls and Patient Injury Falls from the National Database of Nursing Quality Indicators (NDNQI® for the 3rd quarter of 2007 from a convenience sample of over one thousand US hospitals were analyzed. The effect of the nonlinear monotonic transformation was contrasted in two ways: a) estimating the transformation parameter along with factors with potential structural effects, and b) estimating the transformation parameter first and then conducting analysis of variance for the structural effect. Linear model ANOVA with Monte Carlo simulation and mixed models with correlated error terms with NDNQI examples showed no substantial differences on statistical tests for structural effects if the factors with structural effects were omitted during the estimation of the transformation parameter. The Box-Cox power transformation can still be an effective tool for validating statistical inferences with large observational, cross-sectional, and hierarchical or repeated measure studies under the linear or the mixed model settings without prior knowledge of all the factors with potential structural effects.

The Box-Cox power transformation on nursing sensitive indicators: Does it matter if structural effects are omitted during the estimation of the transformation parameter?

Directory of Open Access Journals (Sweden)

Gajewski Byron J

2011-08-01

Full Text Available Abstract Background Many nursing and health related research studies have continuous outcome measures that are inherently non-normal in distribution. The Box-Cox transformation provides a powerful tool for developing a parsimonious model for data representation and interpretation when the distribution of the dependent variable, or outcome measure, of interest deviates from the normal distribution. The objectives of this study was to contrast the effect of obtaining the Box-Cox power transformation parameter and subsequent analysis of variance with or without a priori knowledge of predictor variables under the classic linear or linear mixed model settings. Methods Simulation data from a 3 × 4 factorial treatments design, along with the Patient Falls and Patient Injury Falls from the National Database of Nursing Quality Indicators (NDNQI® for the 3rd quarter of 2007 from a convenience sample of over one thousand US hospitals were analyzed. The effect of the nonlinear monotonic transformation was contrasted in two ways: a estimating the transformation parameter along with factors with potential structural effects, and b estimating the transformation parameter first and then conducting analysis of variance for the structural effect. Results Linear model ANOVA with Monte Carlo simulation and mixed models with correlated error terms with NDNQI examples showed no substantial differences on statistical tests for structural effects if the factors with structural effects were omitted during the estimation of the transformation parameter. Conclusions The Box-Cox power transformation can still be an effective tool for validating statistical inferences with large observational, cross-sectional, and hierarchical or repeated measure studies under the linear or the mixed model settings without prior knowledge of all the factors with potential structural effects.

Effects of nanoparticle heating on the structure of a concentrated aqueous salt solution.

Science.gov (United States)

Sindt, Julien O; Alexander, Andrew J; Camp, Philip J

2017-12-07

The effects of a rapidly heated nanoparticle on the structure of a concentrated aqueous salt solution are studied using molecular dynamics simulations. A diamond-like nanoparticle of radius 20 Å is immersed in a sodium-chloride solution at 20% above the experimental saturation concentration and equilibrated at T = 293 K and P = 1 atm. The nanoparticle is then rapidly heated to several thousand degrees Kelvin, and the system is held under isobaric-isoenthalpic conditions. It is observed that after 2-3 ns, the salt ions are depleted far more than water molecules from a proximal zone 15-25 Å from the nanoparticle surface. This leads to a transient reduction in molality in the proximal zone and an increase in ion clustering in the distal zone. At longer times, ions begin to diffuse back into the proximal zone. It is speculated that the formation of proximal and distal zones, and the increase in ion clustering, plays a role in the mechanism of nonphotochemical laser-induced nucleation.

Effects of nanoparticle heating on the structure of a concentrated aqueous salt solution

Science.gov (United States)

Sindt, Julien O.; Alexander, Andrew J.; Camp, Philip J.

2017-12-01

The effects of a rapidly heated nanoparticle on the structure of a concentrated aqueous salt solution are studied using molecular dynamics simulations. A diamond-like nanoparticle of radius 20 Å is immersed in a sodium-chloride solution at 20% above the experimental saturation concentration and equilibrated at T = 293 K and P = 1 atm. The nanoparticle is then rapidly heated to several thousand degrees Kelvin, and the system is held under isobaric-isoenthalpic conditions. It is observed that after 2-3 ns, the salt ions are depleted far more than water molecules from a proximal zone 15-25 Å from the nanoparticle surface. This leads to a transient reduction in molality in the proximal zone and an increase in ion clustering in the distal zone. At longer times, ions begin to diffuse back into the proximal zone. It is speculated that the formation of proximal and distal zones, and the increase in ion clustering, plays a role in the mechanism of nonphotochemical laser-induced nucleation.

Study on a Salt Evaporation of the Uranium Deposits from an Electro-refiner

International Nuclear Information System (INIS)

Sung Bin Park; Dong Wook Cho; Gyu Hwan Oh; Jong Hyeon Lee; Sung Chan Hwang; Young Ho Kang; Han Soo Lee; Eung Ho Kim; Seong Won Park

2008-01-01

Uranium metal is electrodeposited onto a solid cathode during the electrorefining process. Uranium deposits from an electro-refiner contain about 30∼40 wt% salts. In order to recover pure uranium and transform it into metal ingots, the salts have to be removed. A salt distiller is adapted for a salt evaporation. A batch operation for the salt removal is carried out by a heating and vacuum evaporation. It is operated at 700 ∼ 1000 deg. C and less than 1 Torr, respectively. The behaviors of the salt evaporations were investigated by focusing on the effects of the vacuum pressure and the holding temperature on the salt distillation. The salt removal efficiencies were obtained with regards to the operational conditions. The Hertz-Langmuir relation was applied to the experimental results of the salt evaporations. The effective evaporation coefficients of the relation were obtained with regards to the operational conditions. The lower the vacuum pressure and the higher the holding temperature were, the higher the removal efficiencies of the salts were. (authors)

Salinity Alters the Polyisoprenoid Alcohol Content and Composition of Both Salt-Secreting and Non–Salt-Secreting Mangrove Seedlings

Directory of Open Access Journals (Sweden)

Mohammad Basyuni

2017-10-01

Full Text Available The effects of salinity on the polyisoprenoid alcohol content and composition of the salt-secreting mangrove species Avicennia marina and Sonneratia alba and the non–salt-secreting species Bruguiera gymnorrhiza and Kandelia obovata were studied. The seedlings of mangroves were grown for 5 months under 0% and 3% salt concentrations. The occurrence, content, and distribution of four mangrove seedlings were analyzed by two-dimensional thin layer chromatography. The structural groups of the polyprenols and dolichols in the leaves and roots were classified into two types (I and II. In type I, dolichols predominated over polyprenols (more than 90%, whereas in type II, the occurrence of both polyprenols and dolichols was observed. Polyprenols were not detected in the leaves of A. marina and B. gymnorrhiza under 0% salt (control, but were detected in small amounts in K. obovata leaves; however, significant amounts were found in the 3% salinity group. This finding in A. marina, B. gymnorrhiza, and K. obovata leaves implies a change to the structural group: under 0% salt concentrations, the groups are classified as type I, but become type II under 3% salt concentrations. The occurrence of ficaprenol (C50–55 was found only in the leaves of the non–salt-secreting species B. gymnorrhiza and K. obovata under 3% salinity and not in the salt-secreting species A. marina or S. alba. It is noteworthy that the polyisoprenoid type in the roots of the four species showed no change under salinity; the two salt-secreting species A. marina and S. alba contained type I under 0% and 3% salt concentrations. On the other hand, type II polyisoprenoids were identified in the non–salt-secreting species B. gymnorrhiza and K. obovata under 0% and 3% salinity conditions. This finding suggested that polyisoprenoids play a protective role against salinity in the mangrove leaves of both salt-secreting and non–salt-secreting species.

Physico-chemical analysis of traditional vegetal salts obtained from three provinces of Papua New Guinea

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Janarthanan Gopalakrishnan

2015-06-01

Full Text Available Objective: To determine the chemical constituents of the traditional vegetal salts and find out if they are safe to consume. Methods: Seven different salts have been obtained from three provinces, of which five belong to Morobe Province. The cations were determined using inductively coupled plasma atomic emission spectroscopy and anions using titrimetry, gravimetry and spectrophotometry. Others like solubility, electrical conductivity, pH, antimicrobial, Fourier transform infrared spectral and volatility studies have been carried out for these salts. Results: While few salts were found to be stable, others were deliquescent; and the colour varies from white to black through yellow and brown. It was found that the potassium ion was dominant while others including sodium and calcium were found in lower concentrations. For the first time, certain d-block metal concentrations were measured though most of them were found to be present at very low levels. Other parameters like volatility, solubility, electrical conductivity, antimicrobial and Fourier transform infrared spectral studies were carried out for the first time for these vegetal salts in Papua New Guinea. Conclusions: The salt’s deliquescence could be correlated to the presence of anions like carbonate, bicarbonate and hydroxide which strongly contribute towards it. Similarly, solubility and conductivity of the salts could be correlated well. The salts were found to be harmless for consumption, but for the high potassium content.

Analysis of the temperature field around salt diapirs

DEFF Research Database (Denmark)

Jensen, Peter Klint

1990-01-01

heat flux should be higher over 3D structures. On the other hand the areal extent of the temperature anomaly around the salt structures is less in the 3D case. Calculation examples indicate that low temperature geothermal energy exploitation of the formations around the top of a salt diapir can...

Structural transformations in MoO{sub x} thin films grown by pulsed laser deposition

Energy Technology Data Exchange (ETDEWEB)

Camacho-Lopez, M.A.; Haro-Poniatowski, E. [Departamento de Fisica, Laboratorio de Optica Cuantica, Universidad Autonoma Metropolitana Iztapalapa, Apdo. Postal 55-534, 09340, Mexico D. F. (Mexico); Escobar-Alarcon, L. [Departamento de Fisica, Instituto Nacional de Investigaciones Nucleares, Apdo. Postal 18-1027, 11801, Mexico D. F. (Mexico)

2004-01-01

In this work, laser-induced crystallization in MoO{sub x} thin films (1.8{<=}x{<=}2.1) is reported. This transformation involves a MoO{sub x} oxidation and subsequently a crystallization process from amorphous MoO{sub 3} to crystalline {alpha}MoO{sub 3}. For comparison purposes crystallization is induced thermally, in an oven, as well. The crystallization kinetics is monitored by Raman spectroscopy; a threshold in the energy density necessary to induce the phase transformation is determined in the case of photo-crystallization. This threshold depends on the type of substrate on which the film is deposited. For the thin films deposited on glass substrates, the structural transformation is from amorphous MoO{sub x} to the thermodynamically stable {alpha}MoO{sub 3} crystalline phase. For the thin films deposited on Si(100) the structural transformation is from amorphous MoO{sub x} to a mixture of {alpha}MoO{sub 3} and the thermodynamically unstable {beta}MoO{sub 3} crystalline phases. The structural transformations are also characterized by scanning electron microscopy and light-transmission experiments. (orig.)

In planta Transformed Cumin (Cuminum cyminum L.) Plants, Overexpressing the SbNHX1 Gene Showed Enhanced Salt Endurance.

Science.gov (United States)

Pandey, Sonika; Patel, Manish Kumar; Mishra, Avinash; Jha, Bhavanath

2016-01-01

Cumin is an annual, herbaceous, medicinal, aromatic, spice glycophyte that contains diverse applications as a food and flavoring additive, and therapeutic agents. An efficient, less time consuming, Agrobacterium-mediated, a tissue culture-independent in planta genetic transformation method was established for the first time using cumin seeds. The SbNHX1 gene, cloned from an extreme halophyte Salicornia brachiata was transformed in cumin using optimized in planta transformation method. The SbNHX1 gene encodes a vacuolar Na+/H+ antiporter and is involved in the compartmentalization of excess Na+ ions into the vacuole and maintenance of ion homeostasis Transgenic cumin plants were confirmed by PCR using gene (SbNHX1, uidA and hptII) specific primers. The single gene integration event and overexpression of the gene were confirmed by Southern hybridization and competitive RT-PCR, respectively. Transgenic lines L3 and L13 showed high expression of the SbNHX1 gene compared to L6 whereas moderate expression was detected in L5 and L10 transgenic lines. Transgenic lines (L3, L5, L10 and L13), overexpressing the SbNHX1 gene, showed higher photosynthetic pigments (chlorophyll a, b and carotenoid), and lower electrolytic leakage, lipid peroxidation (MDA content) and proline content as compared to wild type plants under salinity stress. Though transgenic lines were also affected by salinity stress but performed better compared to WT plants. The ectopic expression of the SbNHX1 gene confirmed enhanced salinity stress tolerance in cumin as compared to wild type plants under stress condition. The present study is the first report of engineering salt tolerance in cumin, so far and the plant may be utilized for the cultivation in saline areas.

In planta Transformed Cumin (Cuminum cyminum L. Plants, Overexpressing the SbNHX1 Gene Showed Enhanced Salt Endurance.

Directory of Open Access Journals (Sweden)

Sonika Pandey

Full Text Available Cumin is an annual, herbaceous, medicinal, aromatic, spice glycophyte that contains diverse applications as a food and flavoring additive, and therapeutic agents. An efficient, less time consuming, Agrobacterium-mediated, a tissue culture-independent in planta genetic transformation method was established for the first time using cumin seeds. The SbNHX1 gene, cloned from an extreme halophyte Salicornia brachiata was transformed in cumin using optimized in planta transformation method. The SbNHX1 gene encodes a vacuolar Na+/H+ antiporter and is involved in the compartmentalization of excess Na+ ions into the vacuole and maintenance of ion homeostasis Transgenic cumin plants were confirmed by PCR using gene (SbNHX1, uidA and hptII specific primers. The single gene integration event and overexpression of the gene were confirmed by Southern hybridization and competitive RT-PCR, respectively. Transgenic lines L3 and L13 showed high expression of the SbNHX1 gene compared to L6 whereas moderate expression was detected in L5 and L10 transgenic lines. Transgenic lines (L3, L5, L10 and L13, overexpressing the SbNHX1 gene, showed higher photosynthetic pigments (chlorophyll a, b and carotenoid, and lower electrolytic leakage, lipid peroxidation (MDA content and proline content as compared to wild type plants under salinity stress. Though transgenic lines were also affected by salinity stress but performed better compared to WT plants. The ectopic expression of the SbNHX1 gene confirmed enhanced salinity stress tolerance in cumin as compared to wild type plants under stress condition. The present study is the first report of engineering salt tolerance in cumin, so far and the plant may be utilized for the cultivation in saline areas.

Transform Methods for Precision Nonlinear Wave Models of Flexible space Structures

Science.gov (United States)

1990-08-20

developed, each of which has motivated a structural control methodology in a natural way. The Transform Element Modelling (TEM) approach uses the Laplace...IEk A L 2 = -, c G= ( C .3 a ,b ) Talng the Laplace transfor-m (neglecting initial conditions) )ields [1+tjSZ-(,s) +S ((X’S) + al2a~ pS4 (X’S) j(X’s) (04

[Community structure and diversity of culturable moderate halophilic bacteria isolated from Qrhan salt lake on Qinghai-Tibet Plateau].

Science.gov (United States)

Shen, Shuo

2017-04-04

I studied the community structure and diversity of culturable moderate halophilic bacteria isolated from Qrhan Salt Lake. I isolated and cultured the moderate halophilic bacteria on different selective media. After the 16S rRNA gene sequences was amplified and measured, I constructed the phylogenic tree, analyzed the community structure and calculated the diversity indexes according to the 16S rRNA gene information. A total of 421 moderate halophilic bacteria were isolated from water and mud samples in Qrhan Salt Lake. The 16S rRNA gene information showed that 4 potential novel species belonged to the family Bacillaceae. Eighty-three model strains belonged to 3 phylurms 6 families 16 genus. Among them, Bacillus sp., Oceanobacillus sp. and Halomonas sp. were dominant species. Diversity analysis showed that the diversity of strains isolated from water sample was higher than that from mud sample, but the dominance degree of strains isolated from mud sample was higher than that from water sample. The genetic diversity of moderate halophilic bacteria isolated from Qrhan Salt Lake was abundant. Also, there were dominant and novel species of culturable moderate halophilic bacteria in this lake.

Performance comparison between crystalline and co-amorphous salts of indomethacin-lysine

DEFF Research Database (Denmark)

Kasten, Georgia; Nouri, Khatera; Grohganz, Holger

2017-01-01

The introduction of a highly water soluble amino acid as co-amorphous co-former has previously been shown to significantly improve the dissolution rate of poorly water soluble drugs. In this work, dry ball milling (DBM) and liquid assisted grinding (LAG) were used to prepare different physical...... forms of salts of indomethacin (IND) with the amino acid lysine (LYS), allowing the direct comparison of their solid-state properties to their in vitro performance. X-ray powder diffraction and Fourier-transformed infrared spectroscopy showed that DBM experiments led to the formation of a fully co......-amorphous salt, while LAG resulted in a crystalline salt. Differential scanning calorimetry showed that the samples prepared by DBM had a single glass transition temperature (Tg) of approx. 100°C for the co-amorphous salt, while a new melting point (223°C) was obtained for the crystalline salt prepared by LAG...

Overexpression of WsSGTL1 Gene of Withania somnifera Enhances Salt Tolerance, Heat Tolerance and Cold Acclimation Ability in Transgenic Arabidopsis Plants

Science.gov (United States)

Mishra, Manoj K.; Chaturvedi, Pankaj; Singh, Ruchi; Singh, Gaurav; Sharma, Lokendra K.; Pandey, Vibha; Kumari, Nishi; Misra, Pratibha

2013-01-01

Background Sterol glycosyltrnasferases (SGT) are enzymes that glycosylate sterols which play important role in plant adaptation to stress and are medicinally important in plants like Withania somnifera. The present study aims to find the role of WsSGTL1 which is a sterol glycosyltransferase from W. somnifera, in plant’s adaptation to abiotic stress. Methodology The WsSGTL1 gene was transformed in Arabidopsis thaliana through Agrobacterium mediated transformation, using the binary vector pBI121, by floral dip method. The phenotypic and physiological parameters like germination, root length, shoot weight, relative electrolyte conductivity, MDA content, SOD levels, relative electrolyte leakage and chlorophyll measurements were compared between transgenic and wild type Arabidopsis plants under different abiotic stresses - salt, heat and cold. Biochemical analysis was done by HPLC-TLC and radiolabelled enzyme assay. The promoter of the WsSGTL1 gene was cloned by using Genome Walker kit (Clontech, USA) and the 3D structures were predicted by using Discovery Studio Ver. 2.5. Results The WsSGTL1 transgenic plants were confirmed to be single copy by Southern and homozygous by segregation analysis. As compared to WT, the transgenic plants showed better germination, salt tolerance, heat and cold tolerance. The level of the transgene WsSGTL1 was elevated in heat, cold and salt stress along with other marker genes such as HSP70, HSP90, RD29, SOS3 and LEA4-5. Biochemical analysis showed the formation of sterol glycosides and increase in enzyme activity. When the promoter of WsSGTL1 gene was cloned from W. somnifera and sequenced, it contained stress responsive elements. Bioinformatics analysis of the 3D structure of the WsSGTL1 protein showed functional similarity with sterol glycosyltransferase AtSGT of A. thaliana. Conclusions Transformation of WsSGTL1 gene in A. thaliana conferred abiotic stress tolerance. The promoter of the gene in W.somnifera was found to have stress

Structural Transformation, Biased Technological Change, and Employment in Vietnam

DEFF Research Database (Denmark)

Abbott, Philip; Tarp, Finn; Wu, Ce

2015-01-01

Employment in Vietnam and elsewhere in Asia has grown more slowly than GDP over the last several decades. This means GDP per capita is rising. Vietnamese policymakers, however, are concerned that ongoing structural transformation is creating too few jobs. We use data for seven aggregated sectors ...

Structural transformation, biased technological change, and employment in Vietnam

DEFF Research Database (Denmark)

Abbott, Philip; Tarp, Finn; Wu, Ce

Employment in Vietnam and elsewhere in Asia has grown more slowly than GDP over the last several decades. This means GDP per capita is rising. Vietnamese policymakers, however, are concerned that ongoing structural transformation is creating too few jobs. We use data for seven aggregated sectors ...

Salicylic Acid Alleviates the Adverse Effects of Salt Stress on Dianthus superbus (Caryophyllaceae) by Activating Photosynthesis, Protecting Morphological Structure, and Enhancing the Antioxidant System

Science.gov (United States)

Ma, Xiaohua; Zheng, Jian; Zhang, Xule; Hu, Qingdi; Qian, Renjuan

2017-01-01

Salt stress critically affects the physiological processes and morphological structure of plants, resulting in reduced plant growth. Salicylic acid (SA) is an important signal molecule that mitigates the adverse effects of salt stress on plants. Large pink Dianthus superbus L. (Caryophyllaceae) usually exhibit salt-tolerant traits under natural conditions. To further clarify the salt-tolerance level of D. superbus and the regulating mechanism of exogenous SA on the growth of D. superbus under different salt stresses, we conducted a pot experiment to examine the biomass, photosynthetic parameters, stomatal structure, chloroplast ultrastructure, reactive oxygen species (ROS) concentrations, and antioxidant activities of D. superbus young shoots under 0.3, 0.6, and 0.9% NaCl conditions, with and without 0.5 mM SA. D. superbus exhibited reduced growth rate, decreased net photosynthetic rate (Pn), increased relative electric conductivity (REC) and malondialdehyde (MDA) contents, and poorly developed stomata and chloroplasts under 0.6 and 0.9% salt stress. However, exogenously SA effectively improved the growth, photosynthesis, antioxidant enzyme activity, and stoma and chloroplast development of D. superbus. However, when the plants were grown under severe salt stress (0.9% NaCl condition), there was no significant difference in the plant growth and physiological responses between SA-treated and non-SA-treated plants. Therefore, our research suggests that exogenous SA can effectively counteract the adverse effect of moderate salt stress on D. superbus growth and development. PMID:28484476

Salicylic Acid Alleviates the Adverse Effects of Salt Stress on Dianthus superbus (Caryophyllaceae by Activating Photosynthesis, Protecting Morphological Structure, and Enhancing the Antioxidant System

Directory of Open Access Journals (Sweden)

Xiaohua Ma

2017-04-01

Full Text Available Salt stress critically affects the physiological processes and morphological structure of plants, resulting in reduced plant growth. Salicylic acid (SA is an important signal molecule that mitigates the adverse effects of salt stress on plants. Large pink Dianthus superbus L. (Caryophyllaceae usually exhibit salt-tolerant traits under natural conditions. To further clarify the salt-tolerance level of D. superbus and the regulating mechanism of exogenous SA on the growth of D. superbus under different salt stresses, we conducted a pot experiment to examine the biomass, photosynthetic parameters, stomatal structure, chloroplast ultrastructure, reactive oxygen species (ROS concentrations, and antioxidant activities of D. superbus young shoots under 0.3, 0.6, and 0.9% NaCl conditions, with and without 0.5 mM SA. D. superbus exhibited reduced growth rate, decreased net photosynthetic rate (Pn, increased relative electric conductivity (REC and malondialdehyde (MDA contents, and poorly developed stomata and chloroplasts under 0.6 and 0.9% salt stress. However, exogenously SA effectively improved the growth, photosynthesis, antioxidant enzyme activity, and stoma and chloroplast development of D. superbus. However, when the plants were grown under severe salt stress (0.9% NaCl condition, there was no significant difference in the plant growth and physiological responses between SA-treated and non-SA-treated plants. Therefore, our research suggests that exogenous SA can effectively counteract the adverse effect of moderate salt stress on D. superbus growth and development.

Protein structure analysis using the resonant recognition model and wavelet transforms

International Nuclear Information System (INIS)

Fang, Q.; Cosic, I.

1998-01-01

An approach based on the resonant recognition model and the discrete wavelet transform is introduced here for characterising proteins' biological function. The protein sequence is converted into a numerical series by assigning the electron-ion interaction potential to each amino acid from N-terminal to C-terminal. A set of peaks is found after performing a wavelet transform onto a numerical series representing a group of homologous proteins. These peaks are related to protein structural and functional properties and named characteristic vector of that protein group. Further more, the amino acids contributing mostly to a protein's biological functions, the so-called 'hot spots' amino acids, are predicted by the continuous wavelet transform. It is found that the hot spots are clustered around the protein's cleft structure. The wavelets approach provides a novel methods for amino acid sequence analysis as well as an expansion for the newly established macromolecular interaction model: the resonant recognition model. Copyright (1998) Australasian Physical and Engineering Sciences in Medicine

Community Composition of Nitrous Oxide-Related Genes in Salt Marsh Sediments Exposed to Nitrogen Enrichment.

Science.gov (United States)

Angell, John H; Peng, Xuefeng; Ji, Qixing; Craick, Ian; Jayakumar, Amal; Kearns, Patrick J; Ward, Bess B; Bowen, Jennifer L

2018-01-01

Salt marshes provide many key ecosystem services that have tremendous ecological and economic value. One critical service is the removal of fixed nitrogen from coastal waters, which limits the negative effects of eutrophication resulting from increased nutrient supply. Nutrient enrichment of salt marsh sediments results in higher rates of nitrogen cycling and, commonly, a concurrent increase in the flux of nitrous oxide, an important greenhouse gas. Little is known, however, regarding controls on the microbial communities that contribute to nitrous oxide fluxes in marsh sediments. To address this disconnect, we generated profiles of microbial communities and communities of micro-organisms containing specific nitrogen cycling genes that encode several enzymes ( amoA, norB, nosZ) related to nitrous oxide flux from salt marsh sediments. We hypothesized that communities of microbes responsible for nitrogen transformations will be structured by nitrogen availability. Taxa that respond positively to high nitrogen inputs may be responsible for the elevated rates of nitrogen cycling processes measured in fertilized sediments. Our data show that, with the exception of ammonia-oxidizing archaea, the community composition of organisms involved in the production and consumption of nitrous oxide was altered under nutrient enrichment. These results suggest that previously measured rates of nitrous oxide production and consumption are likely the result of changes in community structure, not simply changes in microbial activity.

Molten salt processing of mixed wastes with offgas condensation

International Nuclear Information System (INIS)

Cooper, J.F.; Brummond, W.; Celeste, J.; Farmer, J.; Hoenig, C.; Krikorian, O.H.; Upadhye, R.; Gay, R.L.; Stewart, A.; Yosim, S.

1991-01-01

We are developing an advanced process for treatment of mixed wastes in molten salt media at temperatures of 700--1000 degrees C. Waste destruction has been demonstrated in a single stage oxidation process, with destruction efficiencies above 99.9999% for many waste categories. The molten salt provides a heat transfer medium, prevents thermal surges, and functions as an in situ scrubber to transform the acid-gas forming components of the waste into neutral salts and immobilizes potentially fugitive materials by a combination of particle wetting, encapsulation and chemical dissolution and solvation. Because the offgas is collected and assayed before release, and wastes containing toxic and radioactive materials are treated while immobilized in a condensed phase, the process avoids the problems sometimes associated with incineration processes. We are studying a potentially improved modification of this process, which treats oxidizable wastes in two stages: pyrolysis followed by catalyzed molten salt oxidation of the pyrolysis gases at ca. 700 degrees C. 15 refs., 5 figs., 1 tab

Protonation of inorganic 5-Fluorocytosine salts

Science.gov (United States)

Souza, Matheus S.; da Silva, Cecília C. P.; Almeida, Leonardo R.; Diniz, Luan F.; Andrade, Marcelo B.; Ellena, Javier

2018-06-01

5-Fluorocytosine (5-FC) has been widely used for the treatment of fungal infections and recently was found to exert an extraordinary antineoplastic activity in gene directed prodrug therapy. However, despite of its intense use, 5-FC exhibits tabletability issues due its physical instability in humid environments, leading to transition from the anhydrous to monohydrate phase. By considering that salt formation is an interesting strategy to overcome this problem, in this paper crystal engineering approach was applied to the supramolecular synthesis of new 5-FC salts with sulfuric, hydrobromic and methanesulfonic inorganic acids. A total of four structures were obtained, namely 5-FC sulfate monohydrate (1:1:1), 5-FC hydrogen sulfate (1:1), 5-FC mesylate (1:1) and 5-FC hydrobromide (1:1), the last one being a polymorphic form of a structure already reported in the literature. These novel salts were structurally characterized by single crystal X-ray diffraction and its supramolecular organization were analyses by Hirshfeld surface analysis. The vibrational behavior was evaluated by Raman spectroscopy and it was found to be consistent with the crystal structures.

Deconstructing the BRICs : Structural Transformation and Aggregate Productivity Growth

NARCIS (Netherlands)

de Vries, Gaaitzen; Erumban, A. A.; Timmer, M.P.; Voskoboynikov, I.; Wu H.X., [No Value

2011-01-01

This paper studies structural transformation and its implications for productivity growth in the BRIC countries based on a new database that provides trends in value added and employment at a detailed 35-sector level. We find that for China, India and Russia reallocation of labour across sectors is

Structural Evolution of Transform Fault Zones in Thick Oceanic Crust of Iceland

Science.gov (United States)

Karson, J. A.; Brandsdottir, B.; Horst, A. J.; Farrell, J.

2017-12-01

Spreading centers in Iceland are offset from the regional trend of the Mid-Atlantic Ridge by the Tjörnes Fracture Zone (TFZ) in the north and the South Iceland Seismic Zone (SISZ) in the south. Rift propagation away from the center of the Iceland hotspot, has resulted in migration of these transform faults to the N and S, respectively. As they migrate, new transform faults develop in older crust between offset spreading centers. Active transform faults, and abandoned transform structures left in their wakes, show features that reflect different amounts (and durations) of slip that can be viewed as a series of snapshots of different stages of transform fault evolution in thick, oceanic crust. This crust has a highly anisotropic, spreading fabric with pervasive zones of weakness created by spreading-related normal faults, fissures and dike margins oriented parallel to the spreading centers where they formed. These structures have a strong influence on the mechanical properties of the crust. By integrating available data, we suggest a series of stages of transform development: 1) Formation of an oblique rift (or leaky transform) with magmatic centers, linked by bookshelf fault zones (antithetic strike-slip faults at a high angle to the spreading direction) (Grimsey Fault Zone, youngest part of the TFZ); 2) broad zone of conjugate faulting (tens of km) (Hreppar Block N of the SISZ); 3) narrower ( 20 km) zone of bookshelf faulting aligned with the spreading direction (SISZ); 4) mature, narrow ( 1 km) through-going transform fault zone bounded by deformation (bookshelf faulting and block rotations) distributed over 10 km to either side (Húsavík-Flatey Fault Zone in the TFZ). With progressive slip, the transform zone becomes progressively narrower and more closely aligned with the spreading direction. The transform and non-transform (beyond spreading centers) domains may be truncated by renewed propagation and separated by subsequent spreading. This perspective

Power density of piezoelectric transformers improved using a contact heat transfer structure.

Science.gov (United States)

Shao, Wei Wei; Chen, Li Juan; Pan, Cheng Liang; Liu, Yong Bin; Feng, Zhi Hua

2012-01-01

Based on contact heat transfer, a novel method to increase power density of piezoelectric transformers is proposed. A heat transfer structure is realized by directly attaching a dissipater to the piezoelectric transformer plate. By maintaining the vibration mode of the transformer and limiting additional energy losses from the contact interface, an appropriate design can improve power density of the transformer on a large scale, resulting from effective suppression of its working temperature rise. A prototype device was fabricated from a rectangular piezoelectric transformer, a copper heat transfer sheet, a thermal grease insulation pad, and an aluminum heat radiator. The experimental results show the transformer maintains a maximum power density of 135 W/cm(3) and an efficiency of 90.8% with a temperature rise of less than 10 °C after more than 36 h, without notable changes in performance. © 2012 IEEE

Rheological stratification of the Hormuz Salt Formation in Iran - microstructural study of the dirty and pure rock salts from the Kuh-e-Namak (Dashti) salt diapir

Science.gov (United States)

Závada, Prokop; Desbois, Guillaume; Urai, Janos; Schulmann, Karel; Rahmati, Mahmoud; Lexa, Ondrej; Wollenberg, Uwe

2014-05-01

Significant viscosity contrasts displayed in flow structures of a mountain namakier (Kuh-e-Namak - Dashti), between 'weak' terrestrial debris bearing rock salt types and 'strong' pure rock salt types are questioned for deformation mechanisms using detailed quantitative microstructural study including crystallographic preferred orientation (CPO) mapping of halite grains. While the solid impurity rich ("dirty") rock salts contain disaggregated siltstone and dolomite interlayers, "clean" salts (debris free) reveal microscopic hematite and remnants of abundant fluid inclusions in non-recrystallized cores of porphyroclasts. Although flow in both, the recrystallized dirty and clean salt types is accommodated by combined mechanisms of pressure-solution creep (PS), grain boundary sliding (GBS) and dislocation creep accommodated grain boundary migration (GBM), their viscosity contrasts are explained by significantly slower rates of intergranular diffusion and piling up of dislocations at hematite inclusions in clean salt types. Porphyroclasts of clean salts deform by semi-brittle and plastic mechanisms with intra-crystalline damage being induced also by fluid inclusions that explode in the crystals at high fluid pressures. Boudins of clean salt types with coarse grained and original sedimentary microstructure suggest that clean rock salts are associated with dislocation creep dominated power law flow in the source layer and the diapiric stem. Rheological contrasts between both rock salt classes apply in general for the variegated and terrestrial debris rich ("dirty") Lower Hormuz and the "clean" rock salt forming the Upper Hormuz, respectively, and suggest that large strain rate gradients likely exist along horizons of mobilized salt types of different composition and microstructure.

Effect of CaO addition on preparation of ferrotitanium from ilmenite by electrochemical reduction in CaCl_2−NaCl molten salt

International Nuclear Information System (INIS)

Xiong, Li; Hua, Yixin; Xu, Cunying; Li, Jian; Li, Yan; Zhang, Qibo; Zhou, Zhongren; Zhang, Yadong; Ru, Juanjian

2016-01-01

Ferro-titanium (FeTi) alloy was prepared successfully from synthesized ilmenite through electrochemical reduction method in equal-molar CaCl_2−NaCl molten salt at 973 K and a cell voltage of 3.2 V under inert atmosphere, where molybdenum rod and graphite were used as cathode and anode respectively. It is indicated that the CaO content in the molten salt has an appreciable effect on the phase transformation of reactants occurring in the electrolytic process. The optimized CaO content in the molten salt is 1 mol% and this suitable content of CaO can significantly improve the reduction rate of ilmenite. The micromorphology of the ferrotitanium product is porous with the amount of 1 mol%CaO addition. It is observed that the particles of ferrotitanium had a uniform size in the initial period of time. Along with the electrolysis time extension, however, the particles connected with each other to generate strips and then form a honeycomb structure. These findings provide a basis for scientifically discussion on the optimization of CaO addition amount during the electrochemical reduction of ilmenite and other oxides in molten salts. - Highlights: • Ferro-titanium was prepared from synthesized ilmenite in CaCl_2−NaCl molten salt. • CaO content has appreciable effect on the phase transformation of ilmenite reactant. • The optimized CaO content is 1 mol% which can significantly improve reaction rate. • The products are connected with each other to form strips as electrolysis time.

Fast Spectrum Molten Salt Reactor Options

Energy Technology Data Exchange (ETDEWEB)

Gehin, Jess C [ORNL; Holcomb, David Eugene [ORNL; Flanagan, George F [ORNL; Patton, Bruce W [ORNL; Howard, Rob L [ORNL; Harrison, Thomas J [ORNL

2011-07-01

During 2010, fast-spectrum molten-salt reactors (FS-MSRs) were selected as a transformational reactor concept for light-water reactor (LWR)-derived heavy actinide disposition by the Department of Energy-Nuclear Energy Advanced Reactor Concepts (ARC) program and were the subject of a preliminary scoping investigation. Much of the reactor description information presented in this report derives from the preliminary studies performed for the ARC project. This report, however, has a somewhat broader scope-providing a conceptual overview of the characteristics and design options for FS-MSRs. It does not present in-depth evaluation of any FS-MSR particular characteristic, but instead provides an overview of all of the major reactor system technologies and characteristics, including the technology developments since the end of major molten salt reactor (MSR) development efforts in the 1970s. This report first presents a historical overview of the FS-MSR technology and describes the innovative characteristics of an FS-MSR. Next, it provides an overview of possible reactor configurations. The following design features/options and performance considerations are described including: (1) reactor salt options-both chloride and fluoride salts; (2) the impact of changing the carrier salt and actinide concentration on conversion ratio; (3) the conversion ratio; (4) an overview of the fuel salt chemical processing; (5) potential power cycles and hydrogen production options; and (6) overview of the performance characteristics of FS-MSRs, including general comparative metrics with LWRs. The conceptual-level evaluation includes resource sustainability, proliferation resistance, economics, and safety. The report concludes with a description of the work necessary to begin more detailed evaluation of FS-MSRs as a realistic reactor and fuel cycle option.

Structural and magnetic transformations in NdMn2Hx hydrides

International Nuclear Information System (INIS)

Budziak, A.; Zachariasz, P.; Pełka, R.; Figiel, H.; Żukrowski, J.; Woch, M.W.

2012-01-01

Highlights: ► Full structural phase diagram is presented for the NdMn 2 H x (2.0 ≤ x ≤ 4.0) hydrides in the temperature range of 70–385 K. ► For samples x = 2.0, 2.5, and 4.0 a splitting into two phases with different hydrogen concentrations are observed. ► Only for samples with x = 3.0 and 3.5 no spinodal decompositions are detected. ► The effects of hydrogen absorption on structural properties are shown to be reflected in magnetic behavior. ► A huge jump of magnetic ordering temperatures from ∼104 K for host NdMn 2 to above 200 K for its hydrides is observed or anticipated. - Abstract: X-ray powder diffraction and bulk magnetization measurements were used to study structural and magnetic properties of hydrides NdMn 2 H x (2.0 ≤ x ≤ 4.0). The X-ray investigations performed in the temperature range 70–385 K have revealed many structural transformations at low temperatures. In particular, a transformation from the hexagonal to the monoclinic phase and spinodal decompositions were observed. The magnetic behavior of the hydrides is correlated with the structural transitions. A tentative structural diagram is presented. The obtained results are compared with the properties of other cubic and hexagonal RMn 2 H x hydrides.

Heterologous Expression of Panax ginseng PgTIP1 Confers Enhanced Salt Tolerance of Soybean Cotyledon Hairy Roots, Composite, and Whole Plants

Directory of Open Access Journals (Sweden)

Jing An

2017-07-01

Full Text Available The Panax ginseng TIP gene PgTIP1 was previously demonstrated to have high water channel activity by its heterologous expression in Xenopus laevis oocytes and in yeast; it also plays a significant role in growth of PgTIP1-transgenic Arabidopsis plants under favorable conditions and has enhanced tolerance toward salt and drought treatment. In this work, we first investigated the physiological effects of heterologous PgTIP1 expression in soybean cotyledon hairy roots or composite plants mediated by Agrobacterium rhizogenes toward enhanced salt tolerance. The PgTIP1-transgenic soybean plants mediated by the pollen tube pathway, represented by the lines N and J11, were analyzed at the physiological and molecular levels for enhanced salt tolerance. The results showed that in terms of root-specific heterologous expression, the PgTIP1-transformed soybean cotyledon hairy roots or composite plants displayed superior salt tolerance compared to the empty vector-transformed ones according to the mitigatory effects of hairy root growth reduction, drop in leaf RWC, and rise in REL under salt stress. Additionally, declines in K+ content, increases in Na+ content and Na+/K+ ratios in the hairy roots, stems, or leaves were effectively alleviated by PgTIP1-transformation, particularly the stems and leaves of composite soybean plants. At the whole plant level, PgTIP1-trasgenic soybean lines were found to possess stronger root vigor, reduced root and leaf cell membrane damage, increased SOD, POD, CAT, and APX activities, steadily increased leaf Tr, RWC, and Pn values, and smaller declines in chlorophyll and carotenoid content when exposed to salt stress compared to wild type. Moreover, the distribution patterns of Na+, K+, and Cl- in the roots, stems, and leaves of salt-stressed transgenic plants were readjusted, in that the absorbed Na+ and Cl- were mainly restricted to the roots to reduce their transport to the shoots, and the transport of root-absorbed K+ to the

Management of the Structural Transformation of Regional Economy

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Khamid Nurislamovich Gizatullin

2018-03-01

Full Text Available The article presents the research of the structural transformation of the economy. The authors have formulated the theoretical concept and the basic reasons for structural transformation of the economy in regions. According to the authors’ approach, the economy should function as a whole system. This defining principle is aimed at the systemic effect. The loss of regions’ control, and, in some cases, deviation from the national goals are the main reasons for the reduction in the Russian economic efficiency. As a result of the liberalization of the economy, the principle of selective investments has become the dominant one as a result of the liberalization of the economy. It broke the synergetic principle used for the formulation of economic strategy. The authors recommend to structure an efficient economy on the basis of the specificity of the economic situation due to its internal state and international realities. We also advise to achieve the balance between regional development and the development of country’s economic competitiveness. The article substantiates the need to overcome the growth of negative trends. These trends are due to the deformation of the most important economic principles and relationships as a result of weakness in the structural and investment policy. Thus, the high-priority task is the orientation of economic development to ensure the technical and technological independence of the economic system. This strategy contains the determining directions for the next development stages. We propose to focus the modernization of the structure of regional economy on the combination of the conceptual foundations of the federal structural policy and regional conditions for its implementation. Regional economy should balance economic initiative and independence in terms of the methods and means for its implementation. We recommend to combine the economic growth with the regional environmental management and the regulation of

Pharmaceutical salts and cocrystals involving amino acids: a brief structural overview of the state-of-art.

Science.gov (United States)

Tilborg, Anaëlle; Norberg, Bernadette; Wouters, Johan

2014-03-03

Salification of new drug substances in order to improve physico-chemical or solid-state properties (e.g. dissolution rate or solubility, appropriate workup process, storage for further industrial and marketing development) is a well-accepted procedure. Amino acids, like aspartic acid, lysine or arginine take a great part in this process and are implicated in several different formulations of therapeutic agent families, including antibiotics (amoxicillin from beta lactam class or cephalexin from cephalosporin class), NSAIDs (ketoprofen, ibuprofen and naproxen from profen family, acetylsalicylic acid) or antiarrhythmic agents (e.g. ajmaline). Even if more than a half of known pharmaceutical molecules possess a salifiable moiety, what can be done for new potential drug entity that cannot be improved by transformation into a salt? In this context, after a brief review of pharmaceutical salts on the market and the implication of amino acids in these formulations, we focus on the advantage of using amino acids even when the target compound is not salifiable by exploiting their zwitterionic potentialities for cocrystal edification. We summarize here a series of new examples coming from literature to support the advantages of broadening the application of amino acids in formulation for new drug substances improvement research for non-salifiable molecules. Copyright © 2013 Elsevier Masson SAS. All rights reserved.

Petrofabric changes in heated and irradiated salt from Project Salt Vault, Lyons, Kansas

International Nuclear Information System (INIS)

Holdoway, K.A.

1972-01-01

Rock salt was heated and irradiated in situ by implanted radioactive wastes during the Project Salt Vault experiment which was carried out at Lyons, Kansas, in the abandoned Carey Salt mine between 1965 and 1967. It was found that irradiation results in coloration of the salt, producing colors ranging from blue-black nearest the radiation source, to pale blue and purple farther from the source. Bleached areas are common in the radiation-colored salt, many representing trails produced by the migration of fluid inclusions towards the heat source. These visible trails are thought to have formed during the cooling down of the salt after the removal of the heaters and radiation sources. The distribution of primary structures in the salt suggests that little migration, if any, occurred during the course of the experiment. It is proposed that radiolysis of the brine within the inclusions may have led to the production of gases which impeded or prevented migration. Evidence of strain was observed in slip planes at 4 in. (10 cm) and between 5.5 and 10 in. (13.5 to 25.4 cm) from the array hole. Deformed bleached areas in the salt between the areas were slip planes are developed suggest that slight plastic deformation or flow may have occurred at 6 in. (15 cm) from the array hole. Differential thermal analysis shows that the maximum amount of stored energy also occurs at 6 in. (15 cm) from the array hole. This region may therefore represent the zone where the combined effect of stress and radiation was greatest

Structural basis for the transformation pathways of the sodium naproxen anhydrate–hydrate system

Science.gov (United States)

Bond, Andrew D.; Cornett, Claus; Larsen, Flemming H.; Qu, Haiyan; Raijada, Dhara; Rantanen, Jukka

2014-01-01

Crystal structures are presented for two dihydrate polymorphs (DH-I and DH-II) of the non-steroidal anti-inflammatory drug sodium (S)-naproxen. The structure of DH-I is determined from twinned single crystals obtained by solution crystallization. DH-II is obtained by solid-state routes, and its structure is derived using powder X-ray diffraction, solid-state 13C and 23Na MAS NMR, and molecular modelling. The validity of both structures is supported by dispersion-corrected density functional theory (DFT-D) calculations. The structures of DH-I and DH-II, and in particular their relationships to the monohydrate (MH) and anhydrate (AH) structures, provide a basis to rationalize the observed transformation pathways in the sodium (S)-naproxen anhydrate–hydrate system. All structures contain Na+/carboxylate/H2O sections, alternating with sections containing the naproxen molecules. The structure of DH-I is essentially identical to MH in the naproxen region, containing face-to-face arrangements of the naphthalene rings, whereas the structure of DH-II is comparable to AH in the naproxen region, containing edge-to-face arrangements of the naphthalene rings. This structural similarity permits topotactic transformation between AH and DH-II, and between MH and DH-I, but requires re-organization of the naproxen molecules for transformation between any other pair of structures. The topotactic pathways dominate at room temperature or below, while the non-topotactic pathways become active at higher temperatures. Thermochemical data for the dehydration processes are rationalized in the light of this new structural information. PMID:25295174

Structural basis for the transformation pathways of the sodium naproxen anhydrate–hydrate system

Directory of Open Access Journals (Sweden)

Andrew D. Bond

2014-09-01

Full Text Available Crystal structures are presented for two dihydrate polymorphs (DH-I and DH-II of the non-steroidal anti-inflammatory drug sodium (S-naproxen. The structure of DH-I is determined from twinned single crystals obtained by solution crystallization. DH-II is obtained by solid-state routes, and its structure is derived using powder X-ray diffraction, solid-state 13C and 23Na MAS NMR, and molecular modelling. The validity of both structures is supported by dispersion-corrected density functional theory (DFT-D calculations. The structures of DH-I and DH-II, and in particular their relationships to the monohydrate (MH and anhydrate (AH structures, provide a basis to rationalize the observed transformation pathways in the sodium (S-naproxen anhydrate–hydrate system. All structures contain Na+/carboxylate/H2O sections, alternating with sections containing the naproxen molecules. The structure of DH-I is essentially identical to MH in the naproxen region, containing face-to-face arrangements of the naphthalene rings, whereas the structure of DH-II is comparable to AH in the naproxen region, containing edge-to-face arrangements of the naphthalene rings. This structural similarity permits topotactic transformation between AH and DH-II, and between MH and DH-I, but requires re-organization of the naproxen molecules for transformation between any other pair of structures. The topotactic pathways dominate at room temperature or below, while the non-topotactic pathways become active at higher temperatures. Thermochemical data for the dehydration processes are rationalized in the light of this new structural information.

Structural basis for the transformation pathways of the sodium naproxen anhydrate-hydrate system.

Science.gov (United States)

Bond, Andrew D; Cornett, Claus; Larsen, Flemming H; Qu, Haiyan; Raijada, Dhara; Rantanen, Jukka

2014-09-01

Crystal structures are presented for two dihydrate polymorphs (DH-I and DH-II) of the non-steroidal anti-inflammatory drug sodium (S)-naproxen. The structure of DH-I is determined from twinned single crystals obtained by solution crystallization. DH-II is obtained by solid-state routes, and its structure is derived using powder X-ray diffraction, solid-state (13)C and (23)Na MAS NMR, and molecular modelling. The validity of both structures is supported by dispersion-corrected density functional theory (DFT-D) calculations. The structures of DH-I and DH-II, and in particular their relationships to the monohydrate (MH) and anhydrate (AH) structures, provide a basis to rationalize the observed transformation pathways in the sodium (S)-naproxen anhydrate-hydrate system. All structures contain Na(+)/carboxylate/H2O sections, alternating with sections containing the naproxen molecules. The structure of DH-I is essentially identical to MH in the naproxen region, containing face-to-face arrangements of the naphthalene rings, whereas the structure of DH-II is comparable to AH in the naproxen region, containing edge-to-face arrangements of the naphthalene rings. This structural similarity permits topotactic transformation between AH and DH-II, and between MH and DH-I, but requires re-organization of the naproxen molecules for transformation between any other pair of structures. The topotactic pathways dominate at room temperature or below, while the non-topotactic pathways become active at higher temperatures. Thermochemical data for the dehydration processes are rationalized in the light of this new structural information.

Structural transformation of MoO3 nanobelts into MoS2 nanotubes

International Nuclear Information System (INIS)

Deepak, Francis Leonard; Mayoral, Alvaro; Yacaman, Miguel Jose

2009-01-01

The structural transformation of MoO 3 nanobelts into MoS 2 nanotubes using a simple sulfur source has been reported. This transformation has been extensively investigated using electron microscopic and spectroscopic techniques including scanning electron microscopy (SEM), transmission electron microscopy (TEM), high-resolution transmission electron microscopy (HRTEM), electron diffraction (ED), and energy-dispersive X-ray analysis (SEM-EDAX and TEM-EDX). The method described in this report will serve as a generic route for the transformation of other oxide nanostructures into the chalcogenide nanostructures. (orig.)

Anaerobic transformation of DDT related to iron(III) reduction and microbial community structure in paddy soils.

Science.gov (United States)

Chen, Manjia; Cao, Fang; Li, Fangbai; Liu, Chengshuai; Tong, Hui; Wu, Weijian; Hu, Min

2013-03-06

We studied the mechanisms of microbial transformation in functional bacteria on 1,1,1-trichloro-2,2-bis(p-chlorophenyl)ethane (DDT) in two different field soils, Haiyan (HY) and Chenghai (CH). The results showed that microbial activities had a steady dechlorination effect on DDT and its metabolites (DDx). Adding lactate or glucose as carbon sources increased the amount of Desulfuromonas, Sedimentibacter, and Clostridium bacteria, which led to an increase in adsorbed Fe(II) and resulted in increased DDT transformation rates. The electron shuttle of anthraquinone-2,6-disulfonic disodium salt resulted in an increase in the negative potential of soil by mediating the electron transfer from the bacteria to the DDT. Moreover, the DDT-degrading bacteria in the CH soil were more abundant than those in the HY soil, which led to higher DDT transformation rates in the CH soil. The most stable compound of DDx was 1,1-dichloro-2,2-bis(p-chloro-phenyl)ethane, which also was the major dechlorination metabolite of DDT, and 1-chloro-2,2-bis-(p-chlorophenyl)ethane and 4,4'-dichlorobenzo-phenone were found to be the terminal metabolites in the anaerobic soils.

Free energy landscape of a minimalist salt bridge model.

Science.gov (United States)

Li, Xubin; Lv, Chao; Corbett, Karen M; Zheng, Lianqing; Wu, Dongsheng; Yang, Wei

2016-01-01

Salt bridges are essential to protein stability and dynamics. Despite the importance, there has been scarce of detailed discussion on how salt bridge partners interact with each other in distinct solvent exposed environments. In this study, employing a recent generalized orthogonal space tempering (gOST) method, we enabled efficient molecular dynamics simulation of repetitive breaking and reforming of salt bridge structures within a minimalist salt-bridge model, the Asp-Arg dipeptide and thereby were able to map its detailed free energy landscape in aqueous solution. Free energy surface analysis shows that although individually-solvated states are more favorable, salt-bridge states still occupy a noticeable portion of the overall population. Notably, the competing forces, e.g. intercharge attractions that drive the formation of salt bridges and solvation forces that pull the charged groups away from each other, are energetically comparable. As the result, the salt bridge stability is highly tunable by local environments; for instance when local water molecules are perturbed to interact more strongly with each other, the population of the salt-bridge states is likely to increase. Our results reveal the critical role of local solvent structures in modulating salt-bridge partner interactions and imply the importance of water fluctuations on conformational dynamics that involves solvent accessible salt bridge formations. © 2015 The Protein Society.

Structural Transformation of Diblock Copolymer/Homopolymer Assemblies by Tuning Cylindrical Confinement and Interfacial Interactions.

Science.gov (United States)

Xu, Jiangping; Wang, Ke; Liang, Ruijing; Yang, Yi; Zhou, Huamin; Xie, Xiaolin; Zhu, Jintao

2015-11-17

In this study, we report the controllable structural transformation of block copolymer/homopolymer binary blends in cylindrical nanopores. Polystyrene-b-poly(4-vinylpyridine)/homopolystyrene (SVP/hPS) nanorods (NRs) can be fabricated by pouring the polymers into an anodic aluminum oxide (AAO) channel and isolated by selective removal of the AAO membrane. In this two-dimensional (2D) confinement, SVP self-assembles into NRs with concentric lamellar structure, and the internal structure can be tailored with the addition of hPS. We show that the weight fraction and molecular weight of hPS and the diameter of the channels can significantly affect the internal structure of the NRs. Moreover, mesoporous materials with tunable pore shape, size, and packing style can be prepared by selective solvent swelling of the structured NRs. In addition, these NRs can transform into spherical structures through solvent-absorption annealing, triggering the conversion from 2D to 3D confinement. More importantly, the transformation dynamics can be tuned by varying the preference property of surfactant to the polymers. It is proven that the shape and internal structure of the polymer particles are dominated by the interfacial interactions governed by the surfactants.

Structural transformations in quenched Fe-Ga alloys

International Nuclear Information System (INIS)

Lograsso, T.A.; Ross, A.R.; Schlagel, D.L.; Clark, A.E.; Wun-Fogle, M.

2003-01-01

It has been speculated that the large increase in magnetostriction in Fe-Ga alloys results from local short-range ordering of the Ga atoms along specific crystallographic directions in the disordered Fe structure. The structural transitions associated with different cooling rates from the high temperature disordered state were investigated with X-ray diffraction of oriented single crystals of Fe-19 at% Ga. Results are presented for long-range ordering during slow cooling and indirect evidence of local short-range ordering of Ga atoms in the disordered state when the alloys are quenched is also presented. In the latter case, the short-range ordering of Ga atoms leads to a tetragonal distortion of the lattice. The dependence of the magnetostrictive response of Fe-Ga alloys on thermal history has been found to be directly related to these structural transformations in Fe-19 at% Ga alloys and experimental support for the proposed magnetostriction model based on Ga-Ga pairing along [100] crystallographic directions is presented

Crystal structure of indoline alkaloids kopsinilam, kopsinine, and the salts of the latter

DEFF Research Database (Denmark)

Adizov, Sh. M.; Tashkhodzhaev, B.; Kunafiev, R. Zh.

2016-01-01

N1 in the bases and the salts. Tetrahedral hybridization of the atom N1 in indoline alkaloids favors the formation of their double salts, what is unlikely for indole and indolinine alkaloids. In the halogen double salts there is an intramolecular Н bond between one of the protons of the NH2 group......Indoline alkaloids kopsinilam and kopsinine extracted from the plant Vinca erecta have been studied by X-ray crystallography; mono and double salts of the latter alkaloid also have been examined. Experimentally determined positions of Н atoms suggest sp3 hybridization of the indoline nitrogen atom...... and the oxygen of the methoxycarbonyl group, that is absent in the mono salts and pure bases....

Structural changes in amorphous organic compounds and their role during chemical transformations

International Nuclear Information System (INIS)

Gusakovskaya, I.G.

1994-01-01

Using butanediol vinylacetate and dimetacrylate as an example, it can be shown that structural changes of amorphous-liquid substance play an important part at chemical transformations of amorphous compounds and chemical reaction rate provides an function of local order. When the amorphous polymer is viewed as an system of multiple transformations, each gives birth to the definite local order, the calculation of recombination reaction of active centers accumulated during irradiation of polymer at 77 K is carried out. Concentration of recombinated centers rises steeply near each transformation T k

Effect of CaO addition on preparation of ferrotitanium from ilmenite by electrochemical reduction in CaCl{sub 2}−NaCl molten salt

Energy Technology Data Exchange (ETDEWEB)

Xiong, Li [Faculty of Metallurgical and Energy Engineering, Kunming University of Science and Technology, Kunming 650093 (China); State Key Lab of Complex Nonferrous Metal Resources Clean Utilization, Kunming 650093 (China); Hua, Yixin, E-mail: yxhua@kmust.edu.cn [Faculty of Metallurgical and Energy Engineering, Kunming University of Science and Technology, Kunming 650093 (China); State Key Lab of Complex Nonferrous Metal Resources Clean Utilization, Kunming 650093 (China); Xu, Cunying; Li, Jian; Li, Yan; Zhang, Qibo; Zhou, Zhongren; Zhang, Yadong [Faculty of Metallurgical and Energy Engineering, Kunming University of Science and Technology, Kunming 650093 (China); State Key Lab of Complex Nonferrous Metal Resources Clean Utilization, Kunming 650093 (China); Ru, Juanjian [Faculty of Material Science and Engineering, Kunming University of Science and Technology, Kunming 650093 (China)

2016-08-15

Ferro-titanium (FeTi) alloy was prepared successfully from synthesized ilmenite through electrochemical reduction method in equal-molar CaCl{sub 2}−NaCl molten salt at 973 K and a cell voltage of 3.2 V under inert atmosphere, where molybdenum rod and graphite were used as cathode and anode respectively. It is indicated that the CaO content in the molten salt has an appreciable effect on the phase transformation of reactants occurring in the electrolytic process. The optimized CaO content in the molten salt is 1 mol% and this suitable content of CaO can significantly improve the reduction rate of ilmenite. The micromorphology of the ferrotitanium product is porous with the amount of 1 mol%CaO addition. It is observed that the particles of ferrotitanium had a uniform size in the initial period of time. Along with the electrolysis time extension, however, the particles connected with each other to generate strips and then form a honeycomb structure. These findings provide a basis for scientifically discussion on the optimization of CaO addition amount during the electrochemical reduction of ilmenite and other oxides in molten salts. - Highlights: • Ferro-titanium was prepared from synthesized ilmenite in CaCl{sub 2}−NaCl molten salt. • CaO content has appreciable effect on the phase transformation of ilmenite reactant. • The optimized CaO content is 1 mol% which can significantly improve reaction rate. • The products are connected with each other to form strips as electrolysis time.

Salicornia europaea L. Na⁺/H⁺ antiporter gene improves salt tolerance in transgenic alfalfa (Medicago sativa L.).

Science.gov (United States)

Zhang, L Q; Niu, Y D; Huridu, H; Hao, J F; Qi, Z; Hasi, A

2014-07-24

In order to obtain a salt-tolerant perennial alfalfa (Medicago sativa L.), we transferred the halophyte Salicornia europaea L. Na(+)/H(+) antiporter gene, SeNHX1, to alfalfa by using the Agrobacterium-mediated transformation method. The transformants were confirmed by both PCR and RT-PCR analyses. Of 197 plants that were obtained after transformation, 36 were positive by PCR analysis using 2 primer pairs for the CaMV35S-SeNHX1 and SeNHX1-Nos fragments; 6 plants survived in a greenhouse. RT-PCR analysis revealed that SeNHX1 was expressed in 5 plants. The resultant transgenic alfalfa had better salt tolerance. After stress treatment for 21 days with 0.6% NaCl, the chlorophyll and MDA contents in transgenic plants were lower, but proline content and SOD, POD, and CAT activities were higher than those in wild-type plants. These results suggest that the salt tolerance of transgenic alfalfa was improved by the overexpression of the SeNHX1 gene.

Synthesis of Quinolines through Three-Component Cascade Annulation of Aryl Diazonium Salts, Nitriles, and Alkynes.

Science.gov (United States)

Wang, Hao; Xu, Qian; Shen, Sheng; Yu, Shouyun

2017-01-06

An efficient and rapid synthesis of multiply substituted quinolines is described. This method is enabled by a three-component cascade annulation of readily available aryl diazonium salts, nitriles, and alkynes. This reaction is catalyst- and additive-free. Various aryl diazonium salts, nitriles, and alkynes can participate in this transformation, and the yields are up to 83%.

Effect of lithium salt concentrations on blended 49% poly(methyl methacrylate) grafted natural rubber and poly(methyl methacrylate) based solid polymer electrolyte

International Nuclear Information System (INIS)

Su’ait, M.S.; Ahmad, A.; Hamzah, H.; Rahman, M.Y.A.

2011-01-01

The effect of lithium salts (lithium tetrafluoroborate, LiBF 4 and lithium perchlorate, LiClO 4 ) as doping salts in rubber-polymer blends, 49% poly(methyl methacrylate) grafted natural rubber (MG49) and poly(methyl methacrylate) (PMMA) in solid polymer electrolyte (SPE) film for electrochemical devices application was investigated. The electrolyte films were prepared via the solution casting technique using 0–25 wt.% lithium salt. The effect of the lithium salts on chemical interaction, ionic conductivity and structural and morphological studies of (70:30) MG49-PMMA films was analyzed using Fourier Transform Infrared (FT-IR) Spectroscopy, Electrochemical Impedance Spectroscopy (EIS), X-ray Diffraction (XRD) and Scanning Electron Microscopy (SEM). Infrared analysis showed that the interactions between lithium ions and oxygen atoms occur at the ether group (C–O–C) (1500–1100 cm −1 ) on the MMA structure in both MG49 and PMMA. The oxygen atoms in the structure of the polymer host act as electron donor atoms and form a coordinate bond with the lithium ions from the doping salt to form polymer–salt complexes. The ionic conductivity was investigated at room temperature as well as at a temperature range from 303 K to 373 K. The ionic conductivity without the addition of salt was 1.1 × 10 −12 S cm −1 . The highest conductivity at room temperature for (70:30) MG49-PMMA–LiBF 4 was 8.6 × 10 −6 S cm −1 at 25 wt.% of LiBF 4 . The ionic conductivity of (70:30) MG49-PMMA–LiClO 4 was 1.5 × 10 −8 S cm −1 at 25 wt.% of LiClO 4 . However, both electrolyte systems do not exhibit Arrhenius-like behavior. Systems with LiBF 4 salt have higher ionic conductivity than those with LiClO 4 salt because of the differences in anionic size and lattice energy of the appropriate salt. The observations from structural and morphology studies showed that complexation and re-crystallization occur in the system. The XRD studies showed a reduction of the MMA peak

Transformation Paths from Cubic to Low-Symmetry Structures in Heusler Ni2MnGa Compound.

Science.gov (United States)

Zelený, Martin; Straka, Ladislav; Sozinov, Alexei; Heczko, Oleg

2018-05-08

In order to explain the formation of low-temperature phases in stoichiometric Ni 2 MnGa magnetic shape memory alloy, we investigate the phase transformation paths from cubic austenite with Heusler structure to low-symmetry martensitic structures. We used ab initio calculations combined with the generalized solid state nudged elastic band method to determine the minimum energy path and corresponding changes in crystal lattice. The four-, five-, and seven-layered modulated phases of martensite (4O, 10M, and 14M) are built as the relaxed nanotwinned non-modulated (NM) phase. Despite having a total energy larger than the other martensitic phases, the 10M phase will spontaneously form at 0 K, because there is no energy barrier on the path and the energy decreases with a large negative slope. Moreover, a similar negative slope in the beginning of path is found also for the transformation to the 6M premartensite, which appears as a local minimum on the path leading further to 10M martensite. Transformation paths to other structures exhibit more or less significant barriers in the beginning hindering such a transformation from austenite. These findings correspond to experiment and demonstrates that the kinetics of the transformation is decisive for the selection of the particular low-symmetry structure.

The multi region molten-salt reactor concept

International Nuclear Information System (INIS)

Gyula, Csom; Sandor, Feher; Szieberth, M.; Szabolcs, Czifrus

2003-01-01

The molten-salt reactor (MSR) concept is one of the most promising systems for the realisation of transmutation. The objective is the development of a transmutation technique along with a device implementing it, which yield higher transmutation efficiencies than that of the known procedures. The procedure is the multi-step transmutation, in which the transformation is carried out in several consecutive steps of different neutron flux and spectrum. In order to implement this, a multi-region transmutation device, i.e. nuclear reactor or sub-critical system is proposed, in which several separate flow-through irradiation rooms are formed with various neutron spectra and fluxes. The paper presents calculations that were performed for a special 5-region version of the multi-region molten-salt reactor. (author)

Seeded Reaction Waves in Composites: Fast Structure Transforming Materials that Respond to Energetic Stimuli

Science.gov (United States)

2016-10-21

change in the structure of the capsule system . The temperatures at which the capsules undergo transformation are in accordance with the results in DSC...Structure- Transforming Materials that Respond to Energetic Stimuli Sb. GRANT NUMBER N00014-13-1-0170 Sc. PROGRAM ELEMENT NUMBER 6. AUTHOR(S) Sd...encapsulated super- cooled fluids into a polymer matrix allows for rapid changes in mechanical properties. Frontal polymerization within a microvascular

Structural-Phase Transformations of CuZn Alloy Under Thermal-Impact Cycling

Science.gov (United States)

Potekaev, A. I.; Chaplygina, A. A.; Kulagina, V. V.; Chaplygin, P. A.; Starostenkov, M. D.; Grinkevich, L. S.

2017-02-01

Using the Monte Carlo method, special features of structural - phase transformations in β-brass are investigated during thermal impact using thermal cycling as an example (a number of successive order - disorder and disorder - order phase transitions in the course of several heating - cooling cycles). It is shown that a unique hysteresis is observed after every heating and cooling cycle, whose presence indicates irreversibility of the processes, which suggests a difference in the structural - phase states both in the heating and cooling stages. A conclusion is drawn that the structural - phase transformations in the heating and cooling stages occur within different temperature intervals, where the thermodynamic stimuli of one or the other structural - phase state are low. This is also demonstrated both in the plots of configurational energy, long- and short-range order parameter, atomic structure variations, and structural - phase state distributions. Simultaneously, there coexist ordered and disordered phases and a certain collection of superstructure domains. This implies the presence of low - stability states in the vicinity of the order - disorder phase transition. The results of investigations demonstrate that the structural - phase transitions within two successive heating and cooling cycles at the same temperature are different in both stages. These changes, though not revolutionary, occur in every cycle and decrease with the increasing cycle number. In fact, the system undergoes training with a tendency towards a certain sequence of structural - phase states.

Complex leadership as a way forward for transformational missional leadership in a denominational structure

Directory of Open Access Journals (Sweden)

C.J.P. (Nelus Niemandt

2015-08-01

Full Text Available The research investigates the role of leadership in the transformation of denominational structures towards a missional ecclesiology, and focusses on the Highveld Synod of the Dutch Reformed Church. It describes the missional journey of the denomination, and interprets the transformation. The theory of ‘complex leadership’ in complex systems is applied to the investigation of the impact of leadership on a denominational structure. The theory identifies three mechanisms used by leaders as enablers in emergent, self-organisation systems: (1 Leaders disrupt existing patterns, (2 they encourage novelty, and (3 they act as sensemakers. These insights are applied as a tool to interpret the missional transformation of a denomination.

Contribution on the influence of transformation structures under consideration of austenite deformation

International Nuclear Information System (INIS)

Peisker, D.; Doktorowski, A.; Dittrich, D.

2001-01-01

Hot forming represents a substantial part of the manufacturing process of many steel products. The crucial microstructural transformation process, which influences the characteristics of a steel considerably, is undisputed the γ/α-transformation. A successful aid to the interpretation of possible microstructural transformation processes during cooling from the austenitizing or deformation temperature is the determination and handling of CCT diagrams. In this article two steels are examined which differ only in their titanium content. Dilatometric investigations were performed varying the three parameters' transformation temperature, strain and cooling strategy. The insights gathered are illustrated and discussed with the aid of CCT diagrams. An additional transformation below A c1 with a brief curing reheat up to A c3 + 20 K leads to a substantially finer structure. The exploitation of this effect may be of great industrial importance. (orig.)

The structural evolution and diffusion during the chemical transformation from cobalt to cobalt phosphide nanoparticles

KAUST Repository

Ha, Don-Hyung

2011-01-01

We report the structural evolution and the diffusion processes which occur during the phase transformation of nanoparticles (NPs), ε-Co to Co 2P to CoP, from a reaction with tri-n-octylphosphine (TOP). Extended X-ray absorption fine structure (EXAFS) investigations were used to elucidate the changes in the local structure of cobalt atoms which occur as the chemical transformation progresses. The lack of long-range order, spread in interatomic distances, and overall increase in mean-square disorder compared with bulk structure reveal the decrease in the NP\\'s structural order compared with bulk structure, which contributes to their deviation from bulk-like behavior. Results from EXAFS show both the Co2P and CoP phases contain excess Co. Results from EXAFS, transmission electron microscopy, X-ray diffraction, and density functional theory calculations reveal that the inward diffusion of phosphorus is more favorable at the beginning of the transformation from ε-Co to Co2P by forming an amorphous Co-P shell, while retaining a crystalline cobalt core. When the major phase of the sample turns to Co 2P, the diffusion processes reverse and cobalt atom out-diffusion is favored, leaving a hollow void, characteristic of the nanoscale Kirkendall effect. For the transformation from Co2P to CoP theory predicts an outward diffusion of cobalt while the anion lattice remains intact. In real samples, however, the Co-rich nanoparticles continue Kirkendall hollowing. Knowledge about the transformation method and structural properties provides a means to tailor the synthesis and composition of the NPs to facilitate their use in applications. © 2011 The Royal Society of Chemistry.

Salt geologic evaluation of the impact of cryogenic fissures and halokinetic deformation processes on the integrity of the geological barrier of the salt dome Gorleben

International Nuclear Information System (INIS)

Hammer, Joerg; Fleig, Stephanie; Mingerzahn, Gerhard

2012-07-01

In several salt domes of the area close to Hannover fissures were observed that might be caused by thermally induced fissure formation due to cold periods (cryogenic fissures). Comprehensive substantial-structural analyses are performed as an example for the salt dome Bokeloh with respect to genesis and transferability to the salt dome Gorleben. Based on recent structure-geological, mineralogical-geochemical and micro-paleontological studies and thermo-mechanical modeling a solely thermally induced fissure formation due to cold periods is unlikely for the salt dome Bokeloh. There is a direct relation between the genesis of the salt dome Bokeloh, its regional tectonic site and the fissure formation. Due to the completely different genesis and another regional-tectonic situation the existence of cryogenic fissures is excluded for the salt dome Gorleben. The salt-geologic and experimental studies on the deformation of anhydrite layers in salt domes are summarized and evaluated with respect to the long-term consequences for a potential final repository for high-level heat-generating radioactive waste in the salt dome Gorleben. The studies confirm the older BGR studies that anhydrite layers do not represent hydraulic potential ling-distance liquid paths.

Structure of nanoparticles in transformer oil-based magnetic fluids, anisotropy of acoustic attenuation

International Nuclear Information System (INIS)

Kúdelčík, Jozef; Bury, Peter; Kopčanský, Peter; Timko, Milan

2015-01-01

The anisotropy of acoustic attenuation in transformer oil-based magnetic fluids upon the external magnetic field was studied to discover the structure of nanoparticles. When a magnetic field is increased, the interaction between the external magnetic field and the magnetic moments of the nanoparticles leads to the aggregation of magnetic nanoparticles and following clusters formation. However, the temperature of magnetic fluids and the concentration of nanoparticles also have very important influence on the structural changes. The measurement of the dependence of the acoustic attenuation on the angle between the magnetic field direction and acoustic wave vector (anisotropy) can give the useful information about the structure of magnetic nanoparticles formations. In the present, the results of anisotropy measurements of the transformer oil-based magnetic fluids are described and using appropriate theory the basic parameters of clusters are calculated. On the basis of the performed calculations, the proportion of the acoustic wave energy used for excitation of the translational and rotational degrees of freedom was also established. - Highlights: • Nanoparticles formation in transformer oil-based magnetic fluids was investigated. • The anisotropy acoustic spectroscopy as the method of investigation was used. • The external conditions on the structure of magnetic fluids were studied. • The structure parameters using suitable theoretical model were determined

Structure of nanoparticles in transformer oil-based magnetic fluids, anisotropy of acoustic attenuation

Energy Technology Data Exchange (ETDEWEB)

Kúdelčík, Jozef, E-mail: kudelcik@fyzika.uniza.sk [Department of Physics, University of Žilina, Univerzitná 1, 010 01 Žilina (Slovakia); Bury, Peter [Department of Physics, University of Žilina, Univerzitná 1, 010 01 Žilina (Slovakia); Kopčanský, Peter; Timko, Milan [Department of Magnetism, IEP SAS, Watsonova 47, 040 01 Košice (Slovakia)

2015-08-15

The anisotropy of acoustic attenuation in transformer oil-based magnetic fluids upon the external magnetic field was studied to discover the structure of nanoparticles. When a magnetic field is increased, the interaction between the external magnetic field and the magnetic moments of the nanoparticles leads to the aggregation of magnetic nanoparticles and following clusters formation. However, the temperature of magnetic fluids and the concentration of nanoparticles also have very important influence on the structural changes. The measurement of the dependence of the acoustic attenuation on the angle between the magnetic field direction and acoustic wave vector (anisotropy) can give the useful information about the structure of magnetic nanoparticles formations. In the present, the results of anisotropy measurements of the transformer oil-based magnetic fluids are described and using appropriate theory the basic parameters of clusters are calculated. On the basis of the performed calculations, the proportion of the acoustic wave energy used for excitation of the translational and rotational degrees of freedom was also established. - Highlights: • Nanoparticles formation in transformer oil-based magnetic fluids was investigated. • The anisotropy acoustic spectroscopy as the method of investigation was used. • The external conditions on the structure of magnetic fluids were studied. • The structure parameters using suitable theoretical model were determined.

The influence of raw material, added emulsifying salt and spray drying on cheese powder structure and hydration properties

DEFF Research Database (Denmark)

Felix da Silva, Denise; Larsen, Flemming Hofmann; Hougaard, Anni Bygvrå

2017-01-01

The present work has evaluated how raw material, addition of emulsifying salts (ES) and drying technology affect particle characteristics, structure, and hydration of cheese powders. In this context the spray drying technology induced the strongest effect on morphology and swelling of cheese powder...

Structural basis for the transformation pathways of the sodium naproxen anhydrate-hydrate system

DEFF Research Database (Denmark)

Bond, Andrew; Cornett, Claus; Larsen, Flemming Hofmann

2014-01-01

to the monohydrate (MH) and anhydrate (AH) structures, provide a basis to rationalize the observed transformation pathways in the sodium (S)-naproxen anhydrate-hydrate system. All structures contain Na(+)/carboxylate/H2O sections, alternating with sections containing the naproxen molecules. The structure of DH...

Structural evolution of dilute magnetic (Sn,Mn)Se films grown by molecular beam epitaxy

Science.gov (United States)

Kanzyuba, Vasily; Dong, Sining; Liu, Xinyu; Li, Xiang; Rouvimov, Sergei; Okuno, Hanako; Mariette, Henri; Zhang, Xueqiang; Ptasinska, Sylwia; Tracy, Brian D.; Smith, David J.; Dobrowolska, Margaret; Furdyna, Jacek K.

2017-02-01

We describe the structural evolution of dilute magnetic (Sn,Mn)Se films grown by molecular beam epitaxy on GaAs (111) substrates, as revealed by transmission electron microscopy, X-ray diffraction, and X-ray photoelectron spectroscopy. When the Mn concentration is increased, the lattice of the ternary (Sn,Mn)Se films evolves quasi-coherently from a SnSe2 two-dimensional (2D) crystal structure into a more complex quasi-2D lattice rearrangement, ultimately transforming into the magnetically concentrated antiferromagnetic MnSe 3D rock-salt structure as Mn approaches 50 at. % of this material. These structural transformations are expected to underlie the evolution of magnetic properties of this ternary system reported earlier in the literature.

Agrobacterium rhizogenes transformed soybean roots differ in their nodulation and nitrogen fixation response to genistein and salt stress.

Science.gov (United States)

Dolatabadian, Aria; Modarres Sanavy, Seyed Ali Mohammad; Ghanati, Faezeh; Gresshoff, Peter M

2013-07-01

We evaluated response differences of normal and transformed (so-called 'hairy') roots of soybean (Glycine max L. (Merr.), cv L17) to the Nod-factor inducing isoflavone genistein and salinity by quantifying growth, nodulation, nitrogen fixation and biochemical changes. Composite soybean plants were generated using Agrobacterium rhizogenes-mediated transformation of non-nodulating mutant nod139 (GmNFR5α minus) with complementing A. rhizogenes K599 carrying the wild-type GmNFR5α gene under control of the constitutive CaMV 35S promoter. We used genetic complementation for nodulation ability as only nodulated roots were scored. After hairy root emergence, primary roots were removed and composite plants were inoculated with Bradyrhizobium japonicum (strain CB1809) pre-induced with 10 μM genistein and watered with NaCl (0, 25, 50 and 100 mM). There were significant differences between hairy roots and natural roots in their responses to salt stress and genistein application. In addition, there were noticeable nodulation and nitrogen fixation differences. Composite plants had better growth, more root volume and chlorophyll as well as more nodules and higher nitrogenase activity (acetylene reduction) compared with natural roots. Decreased lipid peroxidation, proline accumulation and catalase/peroxidase activities were found in 'hairy' roots under salinity stress. Genistein significantly increased nodulation and nitrogen fixation and improved roots and shoot growth. Although genistein alleviated lipid peroxidation under salinity stress, it had no significant effect on the activity of antioxidant enzymes. In general, composite plants were more competitive in growth, nodulation and nitrogen fixation than normal non-transgenic even under salinity stress conditions.

Transformations of diaziridines and their fused analogues induced by electrophilic reagents

International Nuclear Information System (INIS)

Makhova, Nina N; Shevtsov, Alexander V; Petukhova, Vera Yu

2011-01-01

The review deals with transformations of mono- and bicyclic diaziridine derivatives with different types of substitution induced by electrophilic reagents (protic acids, Lewis acids, alkylating and acylating agents, carbonyl compounds, heterocumulenes, activated alkenes and alkynes and transition metal salts). The characteristic features of the reactions are considered as functions of the structures of the starting diaziridines and the nature of the reaction medium (organic solvents, ionic liquids). Prospects of the use of diaziridine derivatives as readily available precursors for the synthesis of various nitrogen-containing heterocyclic systems based on the diaziridine ring expansion reactions are considered. The bibliography includes 136 references.

Structure of transformer oil-based magnetic fluids studied using acoustic spectroscopy

International Nuclear Information System (INIS)

Kúdelčík, Jozef; Bury, Peter; Drga, Jozef; Kopčanský, Peter; Závišová, Vlasta; Timko, Milan

2013-01-01

The structural changes in transformer oil-based magnetic fluids upon the effect of an external magnetic field and temperature were studied by acoustic spectroscopy. The attenuation of acoustic wave was measured as a function of the magnetic field in the range of 0–300 mT and in the temperature range of 15–35 °C for various magnetic nanoparticles concentrations. The effect of anisotropy of the acoustic attenuation was determined, too. The both strong influence of the magnetic field on the acoustic attenuation and its hysteresis were observed. When a magnetic field is increased, the interaction between the external magnetic field and the magnetic moments of the nanoparticles occurs, leading to the aggregation of magnetic nanoparticles and following clusters formation. However, the temperature of magnetic fluids also has very important influence on the structural changes because of the mechanism of thermal motion that acts against the cluster creation. The observed influences of both magnetic field and temperature on the investigated magnetic fluid structure are discussed. - Highlights: ► Structural changes in transformer oil-based magnetic fluids were investigated. ► The acoustic spectroscopy as the method of investigation was used. ► The influence of magnetic field on the structural was studied. ► The influence of temperatures on the structures was investigated, too. ► The influence of external conditions on the structure of MF is interpreted.

Q-mode curve resolution of UV-vis spectra for structural transformation studies of anthocyanins in acidic solutions

International Nuclear Information System (INIS)

Marco, Paulo Henrique; Scarminio, Ieda Spacino

2007-01-01

Chemometric analysis of ultraviolet-visible (UV-vis) spectra for pH values 1.0, 3.3, 5.3, and 6.9 was used to investigate the kinetics and the structural transformations of anthocyanins in extracts of calyces of hibiscus flowers of the Hibiscus acetosella Welw. ex Finicius for the first time. Six different species were detected: the quinoidal base (A), the flavylium cation (AH + ), the pseudobase or carbinol pseudobase (B), cis-chalcone (C C ), trans-chalcone (C t ), and ionized cis-chalcone (C C - ). Four equilibrium constant values were calculated using relative concentrations, hydration, pK h =2.60+/-0.01, tautomeric, K T =0.14+/-0.01, acid-base, pK a =4.24+/-0.04, and ionization of the cis-chalcone, pK C C =8.74+/-1.5x10 -2 . The calculated protonation rate of the tautomers is K H + =0.08+/-7.6x10 -3 . These constants are in excellent agreement with those measured previously in salt form. From a kinetic viewpoint, the situation encountered is interesting since the reported investigation is limited to visible light absorption in acid medium. These models have not been reported in the literature

Control of molten salt corrosion of fusion structural materials by metallic beryllium

International Nuclear Information System (INIS)

Calderoni, P.; Sharpe, P.; Nishimura, H.; Terai, T.

2009-01-01

A series of tests have been performed between 2001 and 2006 at the Safety and Tritium Applied Research facility of the Idaho National Laboratory to demonstrate chemical compatibility between the molten salt flibe (2LiF + BeF 2 in moles) and fusion structural materials once suitable fluoride potential control methods are established. The tests adopted metallic beryllium contact as main fluoride potential control, and the results have been published in recent years. A further step was to expose two specimens of low activation ferritic/martensitic steel 9Cr-2W to static corrosion tests that include an active corrosion agent (hydrofluoric gas) in controlled conditions at 530 deg. C, and the results of the tests are presented in this paper. The results confirmed the expected correlation of the HF recovery with the concentration of metallic impurities dissolved in the salt because of specimen corrosion. The metals concentration dropped to levels close to the detectable limit when the beryllium rod was inserted and increased once the content of excess beryllium in the system had been consumed by HF reduction and specimen corrosion progressed. Metallographic analysis of the samples after 500 h exposure in reactive conditions showed evidence of the formation of unstable chromium oxide layers on the specimen's surface.

Mechanism of growth, composition and structure of oxide films formed on ferrous alloys in molten salt electrolytes - a review

International Nuclear Information System (INIS)

Tzvetkoff, Tz.; Kolchakov, J.

2004-01-01

The growth kinetics, chemical composition and structure of scales formed during corrosion of Fe and its alloys in molten salts are reviewed. Special attention is paid to the effect of the composition of the molten salt mixture and the gas atmosphere on the stability and protective ability of corrosion layers. First, the thermodynamical background of the corrosion and oxidation of Fe-base engineering materials in molten salt media is briefly commented. A concise review of the growth kinetics of passivating oxide films is also presented. These two introductory chapters serve as a guide for the extensive survey of the growth mechanism, nature and properties of oxide and related scales on ferrous alloys in a range of molten electrolytes - chlorides, nitrates, sulphates, carbonates, hydroxides and mixtures thereof in gas atmospheres containing O 2 , CO 2 , SO 2 , SO 3 and HCl

Convenient and General Zinc‐Catalyzed Borylation of Aryl Diazonium Salts and Aryltriazenes under Mild Conditions

Science.gov (United States)

Qi, Xinxin; Jiang, Li‐Bing; Zhou, Chao; Peng, Jin‐Bao

2017-01-01

Abstract A convenient and general zinc‐catalyzed borylation of aryl diazonium salts and aryltriazenes has been developed. With bis‐ (pinacolato)diboron as the borylation reagent, aryldiazonium tetrafluoroborate salts and aryltriazenes were transformed into the corresponding arylboronates in moderate to excellent yields under mild conditions. As a convenient and practical methodology, no additional ligands, base, or any other additives are required here. PMID:28638765

Supramolecular Assembly of Complementary Cyanine Salt J-Aggregates

KAUST Repository

Li, Zhong’ an; Mukhopadhyay, Sukrit; Jang, Sei-Hum; Bredas, Jean-Luc; Jen, Alex K.-Y.

2015-01-01

An understanding of structure–property relationships in cyanine dyes is critical for their design and application. Anionic and cationic cyanines can be organized into complementary cyanine salts, offering potential building blocks to modulate their intra/intermolecular interactions in the solid state. Here, we demonstrate how the structures of these complementary salts can be tuned to achieve highly ordered J-type supramolecular aggregate structures of heptamethine dyes in crystalline solids.

Supramolecular Assembly of Complementary Cyanine Salt J-Aggregates

KAUST Repository

Li, Zhong’an

2015-09-09

An understanding of structure–property relationships in cyanine dyes is critical for their design and application. Anionic and cationic cyanines can be organized into complementary cyanine salts, offering potential building blocks to modulate their intra/intermolecular interactions in the solid state. Here, we demonstrate how the structures of these complementary salts can be tuned to achieve highly ordered J-type supramolecular aggregate structures of heptamethine dyes in crystalline solids.

A new shape design method of salt cavern used as underground gas storage

International Nuclear Information System (INIS)

Wang, Tongtao; Yan, Xiangzhen; Yang, Henglin; Yang, Xiujuan; Jiang, Tingting; Zhao, Shuai

2013-01-01

Graphical abstract: Safety factor contours of four salt cavern gas storages after running 10 years. Highlights: ► We propose a new model to design the shape of salt cavern gas storage. ► The concepts of slope instability and pressure arch are introduced into the shape design. ► The max. gas pressure determines the shapes and dimensions of cavern lower structure. ► The min. gas pressure decides the shapes and dimensions of cavern upper structure. - Abstract: A new model used to design the shape and dimension of salt cavern gas storage is proposed in the paper. In the new model, the cavern is divided into two parts, namely the lower and upper structures, to design. The concepts of slope instability and pressure arch are introduced into the shape design of the lower and upper structures respectively. Calculating models are established according to the concepts. Field salt cavern gas storage in China is simulated as examples, and its shape and dimension are proposed. The effects of gas pressure, friction angle and cohesion of rock salt on the cavern stability are discussed. Moreover, the volume convergence, displacement, plastic volume rate, safety factor, and effective strain are compared with that of three other existing shapes salt caverns to validate the performance of newly proposed cavern. The results show that the max. gas pressure determines the shape and dimension of cavern lower structure, while the min. gas pressure decides that of cavern upper structure. With the increase of friction angle and cohesion of rock salt, the stability of salt cavern is increased. The newly proposed salt cavern gas storage has more notable advantages than the existing shapes of salt cavern in volume convergence, displacement, plastic volume rate, safety factor, and effective strain under the same conditions

Knock-out of Arabidopsis AtNHX4 gene enhances tolerance to salt stress

International Nuclear Information System (INIS)

Li, Hong-Tao; Liu, Hua; Gao, Xiao-Shu; Zhang, Hongxia

2009-01-01

AtNHX4 belongs to the monovalent cation:proton antiporter-1 (CPA1) family in Arabidopsis. Several members of this family have been shown to be critical for plant responses to abiotic stress, but little is known on the biological functions of AtNHX4. Here, we provide the evidence that AtNHX4 plays important roles in Arabidopsis responses to salt stress. Expression of AtNHX4 was responsive to salt stress and abscisic acid. Experiments with CFP-AtNHX4 fusion protein indicated that AtNHX4 is vacuolar localized. The nhx4 mutant showed enhanced tolerance to salt stress, and lower Na + content under high NaCl stress compared with wild-type plants. Furthermore, heterologous expression of AtNHX4 in Escherichia coli BL21 rendered the transformants hypersensitive to NaCl. Deletion of the hydrophilic C-terminus of AtNHX4 dramatically increased the hypersensitivity of transformants, indicating that AtNHX4 may function in Na + homeostasis in plant cell, and its C-terminus plays a role in regulating the AtNHX4 activity.

Knock-out of Arabidopsis AtNHX4 gene enhances tolerance to salt stress

Energy Technology Data Exchange (ETDEWEB)

Li, Hong-Tao; Liu, Hua; Gao, Xiao-Shu [Shanghai Institute of Plant Physiology and Ecology, Chinese Academy of Sciences, 300 Fenglin Road, Shanghai 200032 (China); Zhang, Hongxia, E-mail: hxzhang@sippe.ac.cn [Shanghai Institute of Plant Physiology and Ecology, Chinese Academy of Sciences, 300 Fenglin Road, Shanghai 200032 (China)

2009-05-08

AtNHX4 belongs to the monovalent cation:proton antiporter-1 (CPA1) family in Arabidopsis. Several members of this family have been shown to be critical for plant responses to abiotic stress, but little is known on the biological functions of AtNHX4. Here, we provide the evidence that AtNHX4 plays important roles in Arabidopsis responses to salt stress. Expression of AtNHX4 was responsive to salt stress and abscisic acid. Experiments with CFP-AtNHX4 fusion protein indicated that AtNHX4 is vacuolar localized. The nhx4 mutant showed enhanced tolerance to salt stress, and lower Na{sup +} content under high NaCl stress compared with wild-type plants. Furthermore, heterologous expression of AtNHX4 in Escherichia coli BL21 rendered the transformants hypersensitive to NaCl. Deletion of the hydrophilic C-terminus of AtNHX4 dramatically increased the hypersensitivity of transformants, indicating that AtNHX4 may function in Na{sup +} homeostasis in plant cell, and its C-terminus plays a role in regulating the AtNHX4 activity.

Structure and viscosity of a transformer oil-based ferrofluid under an external electric field

Energy Technology Data Exchange (ETDEWEB)

Rajnak, M., E-mail: rajnak@saske.sk [Institute of Experimental Physics SAS, Watsonova 47, 04001 Košice (Slovakia); Faculty of Electrical Engineering and Informatics, Technical University of Košice, Letná 9, 04200 Košice (Slovakia); Timko, M.; Kopcansky, P.; Paulovicova, K. [Institute of Experimental Physics SAS, Watsonova 47, 04001 Košice (Slovakia); Tothova, J.; Kurimsky, J.; Dolnik, B.; Cimbala, R. [Faculty of Electrical Engineering and Informatics, Technical University of Košice, Letná 9, 04200 Košice (Slovakia); Avdeev, M.V. [Joint Institute for Nuclear Research, Joliot-Curie 6, Moscow region, 141980 Dubna (Russian Federation); Petrenko, V.I. [Joint Institute for Nuclear Research, Joliot-Curie 6, Moscow region, 141980 Dubna (Russian Federation); Taras Shevchenko Kyiv National University, Volodymyrska Street 64, 01601 Kyiv (Ukraine); Feoktystov, A. [Jülich Centre for Neutron Science (JCNS) at Heinz Maier-Leibnitz Zentrum (MLZ), Forschungszentrum Jülich GmbH, Lichtenbergstr. 1, 85748 Garching (Germany)

2017-06-01

Various structural changes of ferrofluids have been intensively studied under external magnetic fields. In this work we present an experimental evidence of similar changes induced by an electric field. In the context of the electric field effect on ferrofluids structure, we studied a simple ferrofluid consisting of iron oxide nanoparticles coated with oleic acid and dispersed in transformer oil. The structural changes have been observed both on macroscopic and microscopic scale. We also demonstrate a remarkable impact of the electric field on the ferrofluid viscosity in relation to the reported structural changes. It was found that the electric field induced viscosity changes are analogous to the magnetoviscous effect. These changes and the electroviscous effect are believed to stem from the dielectric permittivity contrast between the iron oxide nanoparticles and transformer oil, giving rise to the effective electric polarization of the nanoparticles. It is highlighted that this electrorheological effect should be considered in studies of ferrofluids for high voltage engineering applications, as it can have impact on the thermomagnetic convection or the dielectric breakdown performance. - Highlights: • An experimental evidence of the electric field induced structural changes in a ferrofluid is presented. • An electroviscous effect in the transformer oil-based ferrofluid is shown. • The dielectric contrast between the particles and the carrier fluid is the key factor. • The potential impact on the thermomagnetic convection of ferrofluids in power transformers is highlighted.

Coupled modelling of convergence, steel corrosion, gas production and brine flow in a rock salt repository

International Nuclear Information System (INIS)

Becker, D.A.; Hirsekorn, R.P.

2013-01-01

This poster presents the global simulation of the behaviour of thick-walled steel containers piled up in a borehole in a rock salt repository. The simulation takes into account: the convergence by the creeping of rock salt, the backfill and waste compaction, the porosity dependent flow resistance, the anaerobic corrosion (iron to magnetite transformation, gas production, brine consumption, water consumption and salt precipitation) and pressure development. Mechanical influence of corrosion has not yet been taken into account in the integrated code LOPOS

Rolled-up transformer structure for a radiofrequency integrated circuit (RFIC)

Science.gov (United States)

Li, Xiuling; Huang, Wen

2015-01-27

A rolled-up transformer structure comprises a multilayer sheet having a rolled configuration comprising multiple turns about a longitudinal axis. The multilayer sheet comprises more than one conductive pattern layer on a strain-relieved layer, including a first conductive film and a second conductive film separated from the first conductive film in a thickness direction. The first conductive film comprises an even number of primary conductive strips, where each primary conductive strip has a length extending in the rolling direction, and the second conductive film comprises an even number of secondary conductive strips, where each secondary conductive strip has a length extending in the rolling direction. In the rolled configuration, turns of the primary conductive strips and turns of the secondary conductive strips wrap around the longitudinal axis. The primary conductive strips serve as a primary winding and the secondary conductive strips serve as a secondary winding of the rolled-up transformer structure.

Rolled-up transformer structure for a radiofrequency integrated circuit (RFIC)

Science.gov (United States)

Li, Xiuling; Huang, Wen

2016-05-03

A rolled-up transformer structure comprises a multilayer sheet having a rolled configuration comprising multiple turns about a longitudinal axis. The multilayer sheet comprises more than one conductive pattern layer on a strain-relieved layer, including a first conductive film and a second conductive film separated from the first conductive film in a thickness direction. The first conductive film comprises an even number of primary conductive strips, where each primary conductive strip has a length extending in the rolling direction, and the second conductive film comprises an even number of secondary conductive strips, where each secondary conductive strip has a length extending in the rolling direction. In the rolled configuration, turns of the primary conductive strips and turns of the secondary conductive strips wrap around the longitudinal axis. The primary conductive strips serve as a primary winding and the secondary conductive strips serve as a secondary winding of the rolled-up transformer structure.

Structural transformation of nanocrystalline titania by sol-gel and the growth kinetics of crystallites

International Nuclear Information System (INIS)

Hu Linhua; Dai Songyuan; Wang Kongjia

2002-05-01

Structural transformation of nanocrystalline titania prepared by sol-gel with hydrolysis precursor titanium isopropoxide was investigated. At the same time, the growth kinetics of titania powders was also studied here. It was found that the grain size of the powders increased slowly with autoclave heating temperature up to 230 degree C, when hydrolysis pH was 0.9, but grew rapidly when heating temperature was higher that 230 degree C. The activation energies for growth of anatase crystallites in two temperature regions were calculated to be 18.5 kJ/mol and 59.7 kJ/mol respectively. The X-ray diffraction results show that the transformation from anatase phase to rutile phase starts at 230 degree C and structural transformation finished when temperature raises to 270 degree C, which is a temperature much more lower than that of the transformation by conventional literature reports

Structural transformations in austenitic stainless steel induced by deuterium implantation: irradiation at 100 K.

Science.gov (United States)

Morozov, Oleksandr; Zhurba, Volodymyr; Neklyudov, Ivan; Mats, Oleksandr; Rud, Aleksandr; Chernyak, Nikolay; Progolaieva, Viktoria

2015-01-01

Deuterium thermal desorption spectra were investigated on the samples of austenitic stainless steel 18Cr10NiTi preimplanted at 100 K with deuterium ions in the dose range from 3 × 10(15) to 5 × 10(18) D/cm(2). The kinetics of structural transformation development in the implantation steel layer was traced from deuterium thermodesorption spectra as a function of implanted deuterium concentration. At saturation of austenitic stainless steel 18Cr10NiTi with deuterium by means of ion implantation, structural-phase changes take place, depending on the dose of implanted deuterium. The maximum attainable concentration of deuterium in steel is C = 1 (at.D/at.met. = 1/1). The increase in the implanted dose of deuterium is accompanied by the increase in the retained deuterium content, and as soon as the deuterium concentration attains C ≈ 0.5 the process of shear martensitic structural transformation in steel takes place. It includes the formation of bands, body-centered cubic (bcc) crystal structure, and the ferromagnetic phase. Upon reaching the deuterium concentration C > 0.5, the presence of these molecules causes shear martensitic structural transformations in the steel, which include the formation of characteristic bands, bcc crystal structure, and the ferromagnetic phase. At C ≥ 0.5, two hydride phases are formed in the steel, the decay temperatures of which are 240 and 275 K. The hydride phases are formed in the bcc structure resulting from the martensitic structural transformation in steel.

Properties and Structure of In Situ Transformed PAN-Based Carbon Fibers

Directory of Open Access Journals (Sweden)

Jingjing Cao

2018-06-01

Full Text Available Carbon fibers in situ prepared during the hot-pressed sintering in a vacuum is termed in situ transformed polyacrylonitrile-based (PAN-based carbon fibers, and the fibrous precursors are the pre-oxidized PAN fibers. The properties and structure of in situ transformed PAN-based carbon fibers are investigated by Nano indenter, SEM, TEM, XRD, and Raman. The results showed that the microstructure of the fiber surface layer was compact, while the core was loose, with evenly-appearing microvoids. The elastic modulus and nanohardness of the fiber surface layer (303.87 GPa and 14.82 GPa were much higher than that of the core (16.57 GPa and 1.54 GPa, and its interlayer spacing d002 and crystallinity were about 0.347 nm and 0.97 respectively. It was found that the preferred orientation of the surface carbon layers with ordered carbon atomic arrangement tended to be parallel to the fiber axis, whereas the fiber core in the amorphous region exhibited a random texture and the carbon atomic arrangement was in a disordered state. It indicates that the in situ transformed PAN-based carbon fibers possess significantly turbostratic structure and anisotropy.

Charge ordered insulating phases of DODHT salts with octahedral anions and a new radical salt, β''-(DODHT)2TaF6

Science.gov (United States)

Nishikawa, H.; Oshio, H.; Higa, M.; Kondo, R.; Kagoshima, S.; Nakao, A.; Sawa, H.; Yasuzuka, S.; Murata, K.

2008-10-01

Physical properties of isostructural β''-(DODHT)2X [DODHT = (l,4-dioxane-2,3-diyldithio)dihydrotetrathiafulvalene; X = PF6, AsF6, and SbF6] at ambient pressure have been compared. The insulating phase of β''-(DODHT)2PF6 salt has already been revealed to be a charge ordering (CO) state by X-ray diffraction study and magnetic behavior. CO in this salt was also confirmed by the observation of satellite reflections in oscillation photograph using synchrotron radiation. Transport property of β''-(DODHT)2SbF6 salt was reinvestigated up to the pressure of 3.7 GPa applied by a cubic anvil apparatus. Although the SbF6 salt turned to be metallic above 2.0 GPa, no superconductivity was observed. In order to examine the anion size dependence of DODHT salts with octahedral anions, we prepared a new DODHT salt, β''-(DODHT)2TaF6, which has the larger counter anion compared with the previous salts. Crystal structure of this salt was isostructural to the other DODHT salts. The electrical and magnetic properties of this salt were similar to those of β''-(DODHT)2SbF6 salt.

Effect of Elevated Salt Concentrations on the Aerobic Granular Sludge Process : Linking Microbial Activity with Microbial Community Structure

NARCIS (Netherlands)

Bassin, J.P.; Pronk, M.; Muyzer, G.; Kleerebezem, R.; Dezotti, M.; Van Loosdrecht, M.C.M.

2011-01-01

The long- and short-term effects of salt on biological nitrogen and phosphorus removal processes were studied in an aerobic granular sludge reactor. The microbial community structure was investigated by PCR-denaturing gradient gel electrophoresis (DGGE) on 16S rRNA and amoA genes. PCR products

Vitrification in the presence of salts

International Nuclear Information System (INIS)

Marra, J.C.; Andrews, M.K.; Schumacher, R.F.

1994-01-01

Glass is an advantageous material for the immobilization of nuclear wastes because of the simplicity of processing and its unique ability to accept a wide variety of waste elements into its network structure. Unfortunately, some anionic species which are present in the nuclear waste streams have only limited solubility in oxide glasses. This can result in either vitrification concerns or it can affect the integrity, of the final vitrified waste form. The presence of immiscible salts can also corrode metals and refractories in the vitrification unit as well as degrade components in the off-gas system. The presence of a molten salt layer on the melt may alter the batch melting rate and increase operational safety concerns. These safety concerns relate to the interaction of the molten salt and the melter cooling fluids. Some preliminary data from ongoing experimental efforts examining the solubility of molten salts in glasses and the interaction of salts with melter component materials is included

Tailoring of poly(vinyl alcohol cryogels properties by salts addition

Directory of Open Access Journals (Sweden)

2009-05-01

Full Text Available The present paper aims to study the possibility to modify the properties of poly(vinyl alcohol (PVA hydrogels prepared in the presence of different salt types (Na2SO4, NaCl and NaNO3 in order to extend the nature of the salts already used in obtaining films or gels, to expand their concentration domains and to explain the increase of film strain, concomitantly with the increase of their crystallinity. The morphology of the PVA based hydrogels has been studied by Scanning Electronic Microscopy (SEM, the interaction between the PVA macromolecular chains and salts has been determined by Fourier Transform Infrared Spectroscopy (FTIR, while the mechanical properties of the cryogels have been investigated by oscillatory dynamic mechanical measurements. The gels swelling in water have been monitored by gravimetric method in order to evidence the alteration of the PVA cryogel properties such as crystallinity and porosity determined by the salt addition to the initial PVA aqueous solution. The data reported show that the ions present in the PVA solution influence the interaction between PVA-water and PVA-PVA chains; their influence on the salt-based PVA hydrogels follow the Hofmeister lyotropic series.

Invariant 2D object recognition using the wavelet transform and structured neural networks

Science.gov (United States)

Khalil, Mahmoud I.; Bayoumi, Mohamed M.

1999-03-01

This paper applies the dyadic wavelet transform and the structured neural networks approach to recognize 2D objects under translation, rotation, and scale transformation. Experimental results are presented and compared with traditional methods. The experimental results showed that this refined technique successfully classified the objects and outperformed some traditional methods especially in the presence of noise.

Is rising income inequality far from inevitable during structural transformation? A proposal for an augmented inequality dynamics

OpenAIRE

BAEK, Seung Jin

2017-01-01

Abstract. This paper examines whether rising income inequality is the stylised fact for the process of structural transformation by revisiting classical accounts on the transformation-inequality nexus, with a particular focus on Kuznets’s and Rostow’s theories of development and Rawls’s difference principle. In addition, a complex interaction between structural transformation and income inequality is analysed by exploring the multi-dimensions of inequality dynamics to link Kuznets-Rostow-Rawl...

Liking, salt taste perception and use of table salt when consuming reduced-salt chicken stews in light of South Africa's new salt regulations.

Science.gov (United States)

De Kock, H L; Zandstra, E H; Sayed, N; Wentzel-Viljoen, E

2016-01-01

This study investigated the impact of salt reduction on liking, salt taste perception, and use of table salt when consuming chicken stew in light of South Africa's new salt recommendations. In total, 432 South-African consumers (aged 35.2 ± 12.3 years) consumed a full portion of a chicken stew meal once at a central location. Four stock cube powders varying in salt content were used to prepare chicken stews: 1) no reduction - 2013 Na level; regular salt level as currently available on the South African market (24473 mg Na/100 g), 2) salt reduction smaller than 2016 level, i.e. 10%-reduced (22025 mg Na/100 g), 3) 2016 salt level, as per regulatory prescriptions (18000 mg Na/100 g), 4) 2019 salt level, as per regulatory prescriptions (13000 mg Na/100 g). Consumers were randomly allocated to consume one of the four meals. Liking, salt taste perception, and use of table salt and pepper were measured. Chicken stews prepared with reduced-salt stock powders were equally well-liked as chicken stews with the current salt level. Moreover, a gradual reduction of the salt in the chicken stews resulted in a reduced salt intake, up to an average of 19% for the total group compared to the benchmark 2013 Na level stew. However, 19% of consumers compensated by adding salt back to full compensation in some cases. More salt was added with increased reductions of salt in the meals, even to the point of full compensation. Further investigation into the impacts of nutrition communication and education about salt reduction on salt taste perception and use is needed. This research provides new consumer insights on salt use and emphasises the need for consumer-focused behaviour change approaches, in addition to reformulation of products. Copyright © 2015 Elsevier Ltd. All rights reserved.

Development of High Throughput Salt Separation System with Integrated Liquid Salt Separation - Salt Distillation Assembly

Energy Technology Data Exchange (ETDEWEB)

Kwon, Sangwoon; Park, K. M.; Kim, J. G.; Jeong, J. H.; Lee, S. J.; Park, S. B.; Kim, S. S.

2013-01-15

The capacity of a salt distiller should be sufficiently large to reach the throughput of uranium electro-refining process. In this study, an assembly composing a liquid separation sieve and a distillation crucible was developed for the sequential operation of a liquid salt separation and a vacuum distillation in the same tower. The feasibility of the sequential salt separation was examined by the rotation test of the sieve-crucible assembly and sequential operation of a liquid salt separation and a vacuum distillation. The adhered salt in the uranium deposits was removed successfully. The salt content in the deposits was below 0.1 wt% after the sequential operation of the liquid salt separation - salt distillation. From the results of this study, it could be concluded that efficient salt separation can be realized by the sequential operation of liquid salt separation and vacuum distillation in one distillation tower since the operation procedures are simplified and no extra operation of cooling and reheating is necessary.

Measurement of europium (III)/europium (II) couple in fluoride molten salt for redox control in a molten salt reactor concept

Science.gov (United States)

Guo, Shaoqiang; Shay, Nikolas; Wang, Yafei; Zhou, Wentao; Zhang, Jinsuo

2017-12-01

The fluoride molten salt such as FLiNaK and FLiBe is one of the coolant candidates for the next generation nuclear reactor concepts, for example, the fluoride salt cooled high temperature reactor (FHR). For mitigating corrosion of structural materials in molten fluoride salt, the redox condition of the salts needs to be monitored and controlled. This study investigates the feasibility of applying the Eu3+/Eu2+ couple for redox control. Cyclic voltammetry measurements of the Eu3+/Eu2+ couple were able to obtain the concentrations ratio of Eu3+/Eu2+ in the melt. Additionally, the formal standard potential of Eu3+/Eu2+ was characterized over the FHR's operating temperatures allowing for the application of the Nernst equation to establish a Eu3+/Eu2+ concentration ratio below 0.05 to prevent corrosion of candidate structural materials. A platinum quasi-reference electrode with potential calibrated by potassium reduction potential is shown as reliable for the redox potential measurement. These results show that the Eu3+/Eu2+ couple is a feasible redox buffering agent to control the redox condition in molten fluoride salts.

Sea Salt vs. Table Salt: What's the Difference?

Science.gov (United States)

... and healthy eating What's the difference between sea salt and table salt? Answers from Katherine Zeratsky, R.D., L.D. The main differences between sea salt and table salt are in their taste, texture ...

Growth and Structural Transformation in Viet Nam during the 2000s

DEFF Research Database (Denmark)

Thu Hoai, Dang Thi; Tarp, Finn; van Seventer, Dirk

the period 2000–12, while moving from primary production (agriculture) towards more value adding manufacturing activities. This transformation has been broad-based and in large measure driven by external demand. We conclude that it will be challenging to sustain growth without bold moves in technological......We study structural transformation and change in the Vietnamese economy using two Social Accounting Matrices (SAMs), one for the year 2000 and a recently compiled SAM for the year 2012. This period is of particular interest as it features an important shift in terms of more economic integration...

Structure of transformer oil-based magnetic fluids studied using acoustic spectroscopy

Energy Technology Data Exchange (ETDEWEB)

Kudelcik, Jozef, E-mail: kudelcik@fyzika.uniza.sk [Department of Physics, University of Zilina, Univerzitna 1, 010 01 Zilina (Slovakia); Bury, Peter; Drga, Jozef [Department of Physics, University of Zilina, Univerzitna 1, 010 01 Zilina (Slovakia); Kopcansky, Peter; Zavisova, Vlasta; Timko, Milan [Department of Magnetism, IEP SAS, Watsonova 47, 040 01 Kosice (Slovakia)

2013-01-15

The structural changes in transformer oil-based magnetic fluids upon the effect of an external magnetic field and temperature were studied by acoustic spectroscopy. The attenuation of acoustic wave was measured as a function of the magnetic field in the range of 0-300 mT and in the temperature range of 15-35 Degree-Sign C for various magnetic nanoparticles concentrations. The effect of anisotropy of the acoustic attenuation was determined, too. The both strong influence of the magnetic field on the acoustic attenuation and its hysteresis were observed. When a magnetic field is increased, the interaction between the external magnetic field and the magnetic moments of the nanoparticles occurs, leading to the aggregation of magnetic nanoparticles and following clusters formation. However, the temperature of magnetic fluids also has very important influence on the structural changes because of the mechanism of thermal motion that acts against the cluster creation. The observed influences of both magnetic field and temperature on the investigated magnetic fluid structure are discussed. - Highlights: Black-Right-Pointing-Pointer Structural changes in transformer oil-based magnetic fluids were investigated. Black-Right-Pointing-Pointer The acoustic spectroscopy as the method of investigation was used. Black-Right-Pointing-Pointer The influence of magnetic field on the structural was studied. Black-Right-Pointing-Pointer The influence of temperatures on the structures was investigated, too. Black-Right-Pointing-Pointer The influence of external conditions on the structure of MF is interpreted.

Linoleic acid and its potassium and sodium salts: A combined experimental and theoretical study

Science.gov (United States)

Gocen, Tuğba; Haman Bayarı, Sevgi; Haluk Guven, Mehmet

2017-12-01

Linoleic acid (cis, cis-9,12-octodecadienoic acid) is the main polyunsaturated -omega 6- essential fatty acid. The conformational behaviour of linoleic acid (LA) in the gas phase was investigated by means of density functional theory (DFT). The structures of conformers of LA were fully optimized by using the B3LYP/6-311++G(d,p) method. The theory showed that the tttttts‧CssCs‧tt conformation of LA (conformer I) is the more stable than the other conformations. Fourier Transform Infrared (FTIR) and micro-Raman spectra of pure LA in liquid form were recorded in the region 4000-450 and 3500-100 cm-1, respectively. The DFT calculations on the molecular structure and vibrational spectra of the dimer form of most stable conformer of LA were also performed using the same method. The assignment of the vibrational modes was made based on calculated potential energy distributions (PEDs). The simulated spectra of dimer form of LA are in reasonably good agreement with the experimental spectra. The sodium and potassium salts of LA were synthesized and characterized by FTIR and Raman spectroscopy, X-ray diffraction and DFT calculations. Several molecular and electronic properties of LA and its salts such as HOMO-LUMO energies, chemical hardness and electronegativity were also calculated and interpreted.

Raman mapping in the elucidation of solid salt eutectic and near eutectic structures

DEFF Research Database (Denmark)

Berg, Rolf W.; Kerridge, D. H.

2002-01-01

The distribution of the different components of solidified eutectic or near-eutectic salt mixtures (eutectics) was examined by use of Raman microscope mapping of the structures formed when these melts were slowly cooled. Seven binary and one ternary system were investigated. In most cases...... and the composition. When unidirectional cooling was applied it was possible for the system (KCl-Na2SO4, 60:40 mol/mol) to observe lamellar arrangements of the component phases, in an arrangement closely similar to what is frequently found among metallic or ceramic eutectics. Each area, conglomerate or lamellar, did...

A neutron diffraction study on deuterated Rochelle salt structure at - 195degC paraelectric phase

International Nuclear Information System (INIS)

Iwata, Yutaka; Mitani, Shigeshi; Fukui, Susumu; Shibuya, Iwao

1989-01-01

Neutron diffraction study on the low temperature paraelectric phase of Rochelle salt was performed using deuterated single crystal specimen. Large anisotropic thermal motions of atoms are found to be prevailing in the lower paraelectric phase. This indicates the disordering of atoms and the analysis by two-site split-atom method showed that a split atom model holds equally well with an ordinary non-split model. By connecting split positions selectively, a disordered paraelectric structure, which is composed of half-occupied units, was obtained. These units can be regarded as ones in the ferroelectric phase according to a deduction from an order-disorder phase transition scheme. A possibility of existence of the 'local disorder' of O(5)-H group in the tartrate molecule was examined by Fourier method and a result proved to be negative. Present disordered model gives better understanding to the phase transition scheme of Rochelle salt than the local disorder model case. (author)

Microstructural transformation with heat-treatment of aluminum hydroxide with gibbsite structure

International Nuclear Information System (INIS)

Mitsui, Tomohiro; Matsui, Toshiaki; Eguchi, Koichi; Kikuchi, Ryuji

2009-01-01

Aluminum hydroxide with gibbsite structure was prepared, and the microstructural transformation of the sample heat-treated at various temperatures was investigated. The sample was characterized by field emission scanning electron microscopy (FE-SEM), X-ray diffraction (XRD), thermogravimetry and differential thermal analysis (TG-DTA), and BET surface area. The shape of the grains in the prepared sample was hexagonal prism-like morphology. The prepared sample kept a metastable state of alumina phase at higher temperatures than the commercially available gibbsite powders. The prepared gibbsite grains underwent characteristic structural change depending on the calcination temperature. The transformation of the surface morphology was initiated at 400degC, leading to the formation of cracks with the direction parallel to the basal plane. After calcination at 1200degC, a large number of grooves were formed on the surface of the lateral planes. The specific structural change of gibbsite induced by the heat treatment was strongly related to the topotactic dehydration from gibbsite and subsequent phase transition to aluminum oxides. (author)

Structural and electronic transformation in low-angle twisted bilayer graphene

Science.gov (United States)

Gargiulo, Fernando; Yazyev, Oleg V.

2018-01-01

Experiments on bilayer graphene unveiled a fascinating realization of stacking disorder where triangular domains with well-defined Bernal stacking are delimited by a hexagonal network of strain solitons. Here we show by means of numerical simulations that this is a consequence of a structural transformation of the moiré pattern inherent to twisted bilayer graphene taking place at twist angles θ below a crossover angle θ\\star=1.2\\circ . The transformation is governed by the interplay between the interlayer van der Waals interaction and the in-plane strain field, and is revealed by a change in the functional form of the twist energy density. This transformation unveils an electronic regime characteristic of vanishing twist angles in which the charge density converges, though not uniformly, to that of ideal bilayer graphene with Bernal stacking. On the other hand, the stacking domain boundaries form a distinct charge density pattern that provides the STM signature of the hexagonal solitonic network.

Salt-bridging effects on short amphiphilic helical structure and introducing sequence-based short beta-turn motifs.

Science.gov (United States)

Guarracino, Danielle A; Gentile, Kayla; Grossman, Alec; Li, Evan; Refai, Nader; Mohnot, Joy; King, Daniel

2018-02-01

Determining the minimal sequence necessary to induce protein folding is beneficial in understanding the role of protein-protein interactions in biological systems, as their three-dimensional structures often dictate their activity. Proteins are generally comprised of discrete secondary structures, from α-helices to β-turns and larger β-sheets, each of which is influenced by its primary structure. Manipulating the sequence of short, moderately helical peptides can help elucidate the influences on folding. We created two new scaffolds based on a modestly helical eight-residue peptide, PT3, we previously published. Using circular dichroism (CD) spectroscopy and changing the possible salt-bridging residues to new combinations of Lys, Arg, Glu, and Asp, we found that our most helical improvements came from the Arg-Glu combination, whereas the Lys-Asp was not significantly different from the Lys-Glu of the parent scaffold, PT3. The marked 3 10 -helical contributions in PT3 were lessened in the Arg-Glu-containing peptide with the beginning of cooperative unfolding seen through a thermal denaturation. However, a unique and unexpected signature was seen for the denaturation of the Lys-Asp peptide which could help elucidate the stages of folding between the 3 10 and α-helix. In addition, we developed a short six-residue peptide with β-turn/sheet CD signature, again to help study minimal sequences needed for folding. Overall, the results indicate that improvements made to short peptide scaffolds by fine-tuning the salt-bridging residues can enhance scaffold structure. Likewise, with the results from the new, short β-turn motif, these can help impact future peptidomimetic designs in creating biologically useful, short, structured β-sheet-forming peptides.

Solubility of inorganic salts in pure ionic liquids

International Nuclear Information System (INIS)

Pereiro, A.B.; Araújo, J.M.M.; Oliveira, F.S.; Esperança, J.M.S.S.; Canongia Lopes, J.N.; Marrucho, I.M.; Rebelo, L.P.N.

2012-01-01

Highlights: ► We report the solubility of different conventional salts in several ionic liquids. ► The solubility was initially screened using a visual detection method. ► The most promising mixtures were quantitatively re-measured using an ATR–FTIR. - Abstract: The solubility of different conventional salts in several room-temperature ionic liquids – containing ammonium, phosphonium or imidazolium cations combined with acetate, sulfate, sulfonate, thiocyanate, chloride, tetracyano-borate, tris(pentafluoroethyl)trifluoro-phosphate, L-lactate, bis(trifluoromethylsulfonyl)imide or trifluoromethylsulfonate anions – were screened using a visual detection method. The most promising mixtures were then re-measured using an ATR–FTIR (Attenuated Total Reflection Fourier Transform Infra Red) spectroscopy technique in order to accurately and quantitatively determine the corresponding solubility at 298.15 K.

Structural transformations in thermal treatment of carbon material based on Slantsy coke

Energy Technology Data Exchange (ETDEWEB)

Tyumentsev, V.A.; Semenov, P.V.; Podkopaev, S.A.; Noneshneva, N.P.; Golovin, A.V. [Chelyabinsk State University, Chelyabinsk (Russian Federation)

2000-07-01

Structural transformations occurring in a carbon material based on high-sulfur Slantsy coke during isothermal treatment (1200-2400{degree}C) under normal pressure in a nitrogen atmosphere were studied.

Molten salt reactors. Synthesis of studies realized between 1973 and 1983. Carbon-materials file

International Nuclear Information System (INIS)

1983-03-01

The study of a molten salt fueled reactor requires a thorough examination of carbon containing materials for moderator, reflectors and structural materials. Are examined: texture, structure, physical and mechanical properties, chemical purity, neutron irradiation, salt-graphite and salt-lead interactions for different types of graphite. [fr

An interleaved structure for a high-voltage planar transformer for a Travelling-wave Tube

DEFF Research Database (Denmark)

Zhao, Bin; Wang, Gang; Hurley, William G.

2016-01-01

Fully interleaved structure can significantly reduce leakage inductance in transformers, However， it is hard to apply them into high-voltage applications due to the electric insulation. In this paper, a partially interleaved structure that is suitable for high-voltage high frequency applications...... is proposed to reduce leakage inductance and the insulation’s thickness is adjusted to optimize the electric isolation. In addition, the resistance and parasitic capacitance are investigated. With this method, a planar transformer used for a Travelling-Wave Tube Amplifier (TWTA) is designed. Calculations...

Dynamics of prolonged salt movement in the Glückstadt Graben (NW Germany) driven by tectonic and sedimentary processes

Science.gov (United States)

Warsitzka, Michael; Kley, Jonas; Jähne-Klingberg, Fabian; Kukowski, Nina

2017-01-01

The formation of salt structures exerted a major influence on the evolution of subsidence and sedimentation patterns in the Glückstadt Graben, which is part of the Central European Basin System and comprises a post-Permian sediment thickness of up to 11 km. Driven by regional tectonics and differential loading, large salt diapirs, salt walls and salt pillows developed. The resulting salt flow significantly influenced sediment distribution in the peripheral sinks adjacent to the salt structures and overprinted the regional subsidence patterns. In this study, we investigate the geometric and temporal evolution of salt structures and subsidence patterns in the central Glückstadt Graben. Along a key geological cross section, the post-Permian strata were sequentially decompacted and restored in order to reconstruct the subsidence history of minibasins between the salt structures. The structural restoration reveals that subsidence of peripheral sinks and salt structure growth were initiated in Early to Middle Triassic time. From the Late Triassic to the Middle Jurassic, salt movement and salt structure growth never ceased, but were faster during periods of crustal extension. Following a phase from Late Jurassic to the end of the early Late Cretaceous, in which minor salt flow occurred, salt movement was renewed, particularly in the marginal parts of the Glückstadt Graben. Subsidence rates and tectonic subsidence derived from backstripping of 1D profiles reveal that especially the Early Triassic and Middle Keuper times were periods of regional extension. Three specific types of salt structures and adjacent peripheral sinks could be identified: (1) Graben centre salt walls possessing deep secondary peripheral sinks on the sides facing away from the basin centre, (2) platform salt walls, whose main peripheral sinks switched multiple times from one side of the salt wall to the other, and (3) Graben edge pillows, which show only one peripheral sink facing the basin centre.

Molten salt breeder reactor

International Nuclear Information System (INIS)

Furukawa, Kazuo; Tsukada, Kineo; Nakahara, Yasuaki; Oomichi, Toshihiko; Oono, Hideo.

1982-01-01

Purpose: To simplify the structure, as well as improve the technical reliability and safety by the elimination of a proton beam entering window. Constitution: The nuclear reactor container main body is made of Hastelloy N and provided at the inner surface with two layers of graphite shields except for openings. An aperture was formed in the upper surface of the container, through which protons accelerated by a linear accelerator are directly entered to the liquid surface of molten salts such as 7LiF-BeF 2 -ThF 4 , 7LiF-NaF-ThF 4 , 7LiF-Rb-UF 4 , NaF-KF-UF 4 and the like. The heated molten salts are introduced by way of a pipeway into a heat exchanger where the heat is transferred to coolant salts and electric generation is conducted by way of heated steams. (Furukawa, Y.)

Structural analysis of salt cavities formed by solution mining: I. Method of analysis and preliminary results for spherical cavities

International Nuclear Information System (INIS)

Fossum, A.F.

1976-01-01

The primary objective of this effort is an analysis of the structural stability of cavities formed by solution mining in salt domes. In particular, the effects of depth (i.e. initial state of in situ stress), shape, volume (i.e. physical dimensions of the cavity), and sequence of salt excavation/fluid evacuation on the timewise structural stability of a cavity are of interest. It is anticipated that an assessment can be made of the interrelation between depth, cavern size, and cavern shape or of the practical limits therewith. In general, the cavity shape is assumed to be axisymmetric and the salt is assumed to exhibit nonlinear creep behavior. The primary emphasis is placed on the methodology of the finite element analysis, and the results of preliminary calculations for a spherically shaped cavity. It is common practice for engineers to apply elasticity theory to the behavior of rock in order to obtain near field stresses and displacements around an underground excavation in an effort to assess structural stability. Rock masses, particularly at depth, may be subjected to a rather complex state of initial stress, and may be nonhomogeneous and anisotropic. If one also includes complex geometrical excavation shape, the use of analytical techniques as an analysis tool is practically impossible. Thus, it is almost a necessity that approximate solution techniques be employed. In this regard, the finite element method is ideal as it can handle complex geometries and nonlinear material behavior with relative ease. An unusual feature of the present study is the incorporation into the finite element code of a procedure for handling the gradual creation or excavation of an underground cavity. During the excavation sequence, the salt is permitted to exhibit nonlinear stress-strain-time dependence. The bulk of this report will be devoted to a description of the analysis procedures, together with a preliminary calculation for a spherically shaped cavity

Extremely halophilic archaea from ancient salt sediments and their possible survival in halite fluid inclusions

Science.gov (United States)

Stan-Lotter, H.; Fendrihan, S.; Gerbl, F. W.; Dornmayr-Pfaffenhuemer, M.; Frethem, C.

2008-09-01

Halophilic archaebacteria (haloarchaea) thrive in environments with salt concentrations approaching saturation, such as natural brines, marine solar salterns and alkaline salt lakes; they have also been isolated from ancient subsurface salt sediments of great geological age (195-280 million years) and some of those strains were described as novel species (1). The cells survived perhaps while being enclosed within small fluid inclusions in the halite. The characterization of subsurface microbial life is of astrobiological relevance since extraterrestrial halite has been detected and since microbial life on Mars, if existent, may have retreated into the subsurface. We attempted to simulate the embedding process of extremely halophilic archaea and to analyse any cellular changes which might occur. When enclosing haloarchaea in laboratory grown halite, cells accumulated preferentially in fluid inclusions, as could be demonstrated by pre-staining with fluorescent dyes. With increased time of embedding, rod-shaped cells of Halobacterium salinarum strains were found to assume roundish morphologies. Upon dissolution of the salt crystals, these spheres were stable and viable for months when kept in buffers containing 4 M NaCl. Scanning electron microscopy (SEM) following fixation with glutaraldehyde suggested a potentially gradual transformation from rods to spheres. This notion was supported by fluorescence microscopy of Halobacterium cells, following embedding in halite and staining with SYTO 9. One-dimensional protein patterns of rods and spheres, following SDS polyacrylamide gel electrophoresis, were similar except that the S-layer protein appeared reduced by about 15 - 20 % in spheres. The reddish-orange pigmentation of spheres was much lighter compared to that of rod-shaped cells, suggesting lowered concentrations of carotenoids; this was confirmed by extraction and spectrometry of pigments. The data suggested that Halobacterium cells are capable of forming specific

Acoustic investigation of structure of magnetic fluids based on transformer oil mogul

International Nuclear Information System (INIS)

Kudelcik, J.; Bury, P.; Kopcansky, P.; Timko, M.

2013-01-01

In this paper the authors study the influence of temperature on the changes of the acoustic attenuation in magnetic fluids based on transformer oil MOGUL caused by an external magnetic field measured. The influences of both magnetic field and temperature on the structures of investigated magnetic fluids based on the transformer oil MOGUL were observed using acoustic spectroscopy. The effect of external magnetic field on the creation of clusters of nanoparticles in magnetic fluids was confirmed and their influence on the development of attenuation was described. In this type of magnetic fluid complicated structures of clusters at magnetic field over 100 mT are created. These structures are than at higher magnetic field almost stable. This state of equilibrium is not function of time. Measurements also confirmed that the lifetime of these structures or clusters is very short. The further investigation of the time and temperature dependences of the acoustic attenuation on the magnetic field at different concentrations of magnetic nanoparticles and various direction of magnetic field are necessary to understand all processes in this magnetic fluid. (authors)

On the isomers of pyridine-4-carboxaldoxime and its nitrate salt, X-ray crystal structure and quantum chemical calculations

Science.gov (United States)

Soliman, Saied M.; Albering, Jörg; Abu-Youssef, Morsy A. M.

2017-07-01

The reaction between nitric acid and pyridine-4-carboxaldoxime (P4A) afford the corresponding pyridinum nitrate salt (P4AN). Its X-ray structure is measured and compared with the related P4A salts. The DFT/B3LYP results showed that both the P4A and P4AN favored the Syn-I form which has the lowest energy among the other possible isomers. Transition state calculations predicted that the Syn-I form is the thermodynamically and kinetically most stable form. The X-ray solid state structure of the new nitrate salt (P4AN) indicated that the labile proton favored the N-atom of the pyridine ring. DFT studies showed that the same is true for its solution in polar solvents. In contrast, the pyridinium cation is not favored either in the gas phase or solution of P4AN in nonpolar solvent. In these cases, the proton favored to bond with one O-atom from the nitrate group. Second order interaction energies and Mayer bond order values revealed these results. The bond order of the Nsbnd H bond is higher in polar solvents as well as at the experimental structure than either in the gas phase or non polar solvents. The topology parameters obtained from the atoms in molecules (AIM) analysis were used to describe the nature of the Nsbnd H and Osbnd H bonds. The bond critical points (BCP) were found to be close to the H-atoms in case of stronger interaction.

Calibrating a Salt Water Intrusion Model with Time-Domain Electromagnetic Data

DEFF Research Database (Denmark)

Herckenrath, Daan; Odlum, Nick; Nenna, Vanessa

2013-01-01

Salt water intrusion models are commonly used to support groundwater resource management in coastal aquifers. Concentration data used for model calibration are often sparse and limited in spatial extent. With airborne and ground-based electromagnetic surveys, electrical resistivity models can......, we perform a coupled hydrogeophysical inversion (CHI) in which we use a salt water intrusion model to interpret the geophysical data and guide the geophysical inversion. We refer to this methodology as a Coupled Hydrogeophysical Inversion-State (CHI-S), in which simulated salt concentrations...... are transformed to an electrical resistivity model, after which a geophysical forward response is calculated and compared with the measured geophysical data. This approach was applied for a field site in Santa Cruz County, California, where a time-domain electromagnetic (TDEM) dataset was collected...

Investigation of phase transformation for ferrite–austenite structure in stainless steel thin films

Energy Technology Data Exchange (ETDEWEB)

Merakeb, Noureddine [Laboratory of Physical Metallurgy and Property of Materials (LM2PM), Metallurgy and Materials Engineering Department, Badji Mokhtar University, P.O. Box 12, Annaba 23000 (Algeria); Messai, Amel [Laboratoire d' Ingénierie et Sciences des Matériaux Avancés (ISMA), Institut des Sciences et Technologie, Abbès Laghrour University, Khenchela 40000 (Algeria); Ayesh, Ahmad I., E-mail: ayesh@qu.edu.qa [Department of Mathematics, Statistics and Physics, Qatar University, Doha (Qatar)

2016-05-01

In this work we report on phase transformation of 304 stainless steel thin films due to heat treatment. Ex-situ annealing was applied for evaporated 304 stainless steel thin films inside an ultra-high vacuum chamber with a pressure of 3 × 10{sup −7} Pa at temperatures of 500 °C and 600 °C. The structure of thin films was studied by X-ray diffraction (XRD) and conversion electron Mössbauer spectroscopy (CEMS) techniques. The results revealed a transformation from α-phase that exhibits a body-centered cubic structure (BCC) to γ-phase that exhibits a face-centered cubic (FCC) due to annealing. In addition, the percentage of γ-phase structure increased with the increase of annealing temperature. Annealing thin films increased the crystal size of both phases (α and γ), however, the increase was nonlinear. The results also showed that phase transformation was produced by recrystallization of α and γ crystals with a temporal evolution at each annealing temperature. The texture degree of thin films was investigated by XRD rocking curve method, while residual stress was evaluated using curvature method. - Highlights: • Stainless steel thin films were fabricated by thermal evaporation on quartz. • Alpha to gamma phase transformation of thin films was investigated. • Annealing of thin films reduces disruption in crystal lattice. • The stress of as-grown thin films was independent on the thin film thickness. • The stress of the thin films was reduced due to annealing.

Crystal and molecular structures of sixteen charge-assisted hydrogen bond-mediated diisopropylammonium salts from different carboxylic acids

Science.gov (United States)

Lin, Zhihao; Hu, Kaikai; Jin, Shouwen; Ding, Aihua; Wang, Yining; Dong, Lingfeng; Gao, Xingjun; Wang, Daqi

2017-10-01

salts were also reported. And their structural and supramolecular aspects are fully analyzed. The result reveals that among the sixteen investigated crystals the NH groups in the diisopropylamine are protonated when the carboxylic acids are deprotonated, and the crystal packing is interpreted in terms of the strong charge-assisted Nsbnd H⋯O hydrogen bond formation between the ammonium and the deprotonated COOH groups. Except the Nsbnd H⋯O hydrogen bond, the Osbnd H⋯O hydrogen bonds (charge assisted or neutral) were also found at the salts 6, 8, 9, 10, 12, 13, 14, 15, and 16. Further analysis of the crystal packing of the salts indicated that a different family of additional CHsbnd O/CH2sbnd O/CH3sbnd O, CH-π/CH3-π, CH3-Cπ, N-π, and π-π associations contribute to the stabilization and expansion of the total structures. For the coexistence of the various weak interactions these structures adopted homo or hetero supramolecular synthons or both.

Understanding the chemical and structural transformations of lignin macromolecule during torrefaction

International Nuclear Information System (INIS)

Wen, Jia-Long; Sun, Shao-Long; Yuan, Tong-Qi; Xu, Feng; Sun, Run-Cang

2014-01-01

Highlights: • The terrified bamboo has a high energy yield of 85.7% and a HHV of 20.13 MJ/kg. • The structural changes of hemicelluloses, cellulose, and lignin were investigated. • First study on the structural transformations of lignin during torrefaction. • The mechanism of structural changes of lignin has been proposed. - Abstract: Torrefaction is an efficient method to recover energy from biomass. Herein, the characteristics (mass yield, energy yield, physical, and chemical characteristics) of torrefied bamboo at diverse temperatures (200–300 °C) were firstly evaluated by elemental analysis, XRD, and CP–MAS 13 C NMR methodologies. Under an optimal condition the terrified bamboo has a relative high energy yield of 85.7% and a HHV of 20.13 MJ/kg. The chemical and structural transformations of lignin induced by thermal treatment were thoroughly investigated by FT-IR and solution-state NMR techniques (quantitative 13 C NMR, 2D-HSQC, and 31 P-NMR methodologies). The results highlighted the chemical reactions of the native bamboo lignins towards severe torrefaction treatments occurred, such as depolymerization, demethoxylation, bond cleavage, and condensation reactions. NMR results indicated that aryl-ether bonds (β-O-4) and p-coumaric ester in lignin were cleaved during the torrefaction process at mild conditions. The severe treatments of bamboo (275 °C and 300 °C) induced a dramatic enrichment in lignin content together with the almost complete disappearance of β-O-4, β-β, and β-5 linkages. Further analysis of the molecular weight of milled wood lignin (MWL) indicated that the average molecular weights of “torrefied MWL” were lower than those of control MWL. It is believed that understanding of the reactivity and chemical transformations of lignin during torrefaction will contribute to the integrated torrefaction mechanism

Mass transport in bedded salt and salt interbeds

International Nuclear Information System (INIS)

Hwang, Y.; Pigford, T.H.; Chambre, P.L.; Lee, W.W.L.

1989-08-01

Salt is the proposed host rock for geologic repositories of nuclear waste in several nations because it is nearly dry and probably impermeable. Although experiments and experience at potential salt sites indicate that salt may contain brine, the low porosity, creep, and permeability of salt make it still a good choice for geologic isolation. In this paper we summarize several mass-transfer and transport analyses of salt repositories. The mathematical details are given in our technical reports

Oil exudation and histological structures of duck egg yolks during brining.

Science.gov (United States)

Lai, K M; Chung, W H; Jao, C L; Hsu, K C

2010-04-01

Changes in oil exudation and histological structures of salted duck egg yolks during brining up to 5 wk were investigated. During brining, the salt contents of albumen, exterior yolk (hardened portion), and interior yolk (soft or liquid portion) gradually increased accompanied by slight decreases in moisture content. The hardening ratio of salted egg yolks increased rapidly to about 60% during the first week of brining and then reached 100% at the end of brining. After brining, part of the lipids in salted egg yolk became free due to the structural changes of low-density lipoprotein induced by dehydration and increase of salt content, and more free lipids in salted egg yolk were released after the cooking process. With the brining time increased up to 5 wk, the outer region of the cooked salted yolk gradually changed into dark brown, brown, orange, and then dark brown, whereas the center region changed into light yellow, yellow, dark yellow, and then yellow again. The microstructures of cooked salted egg yolks showed that the yolk spheres in the outer and middle regions retained their original shape, with some shrinking and being packed more loosely when brining time increased, and the exuded oil filled the space between the spheres. Furthermore, the yolk spheres in the center region transformed to a round shape but still showed granulation after 4 wk of brining, whereas they were mostly disrupted after 2 to 5 wk of brining. One of the most important characteristics of cooked salted egg yolks, gritty texture, contributed to oil exudation and granulated yolk spheres were observed at the brining time of 4 wk.

Structural, vibrational and thermal characterization of phase transformation in L-histidinium bromide monohydrate single crystals

Energy Technology Data Exchange (ETDEWEB)

Moura, G.M. [Universidade Federal do Maranhão, CCSST, Imperatriz, MA, 65900-410 (Brazil); Universidade Federal do Sul e Sudeste do Pará, ICEN, Marabá, PA 68505-080 (Brazil); Carvalho, J.O. [Universidade Federal do Maranhão, CCSST, Imperatriz, MA, 65900-410 (Brazil); Instituto Federal do Tocantins, Araguaína, TO, 77.826-170 (Brazil); Silva, M.C.D.; Façanha Filho, P.F. [Universidade Federal do Maranhão, CCSST, Imperatriz, MA, 65900-410 (Brazil); Santos, A.O. dos, E-mail: adenilson1@gmail.com [Universidade Federal do Maranhão, CCSST, Imperatriz, MA, 65900-410 (Brazil)

2015-09-01

L-Histidinium bromide monohydrate (LHBr) single crystal is a nonlinear optical material. In this work the high temperature phase transformation and the thermal stability of single crystals of LHBr was investigated by X-ray diffraction, thermogravimetric analysis, differential thermal analysis, differential scanning calorimetry and Raman spectroscopy. The results showed the LHBr phase transformation of orthorhombic (P2{sub 1}2{sub 1}2{sub 1}) to monoclinic system (P 1 2 1) at 120 °C, with the lattice parameters a = 12.162(1) Å, b = 16.821(2) Å, c = 19.477(2) Å and β = 108.56(2)°. These techniques are complementary and confirm the structural phase transformation due to loss water of crystallization. - Highlights: • -histidinium bromide single crystal was grown by slow evaporation technique. • X-ray diffraction characterize the high-temperature phase transformation. • The structural phase transformation occur due to loss of water of crystallization. • The LHBr thermal expansion coefficients exhibit an anisotropic behavior.

In vitro selection of mutants: Inducible gene regulation for salt tolerance

International Nuclear Information System (INIS)

Winicov, I.; Bastola, D.R.; Deutch, C.E.; Pethe, V.V.; Petrusa, L.

2001-01-01

Regulation of differentially expressed genes in plants may be involved in inducing tolerance to stress. Isogenic salt-sensitive and salt-tolerant alfalfa lines were investigated for molecular differences in their response to salt. The genes, which are differentially induced by salt in the salt-tolerant alfalfa cells and are also regulated by salt at the whole plant level, were cloned. Both transcriptional and post- transcriptional mechanisms influenced salt-induced product accumulation in the salt-tolerant alfalfa. The salt-tolerant plants doubled proline concentration rapidly in roots, while salt-sensitive plants showed a delayed response. To understand the regulatory system in the salt-tolerant alfalfa, two genes that are expressed in roots were studied. Alfin1 encodes a zinc-finger type putative DNA transcription factor conserved in alfalfa, rice and Arabidopsis, and MsPRP2 encodes a protein that serves as a cell wall- membrane linker in roots. Recombinant Alfin1 protein was selected, amplified, cloned and its consensus sequence was identified. The recombinant Alfin1 also bound specifically to fragments of the MsPRP2 promoter in vitro, containing the Alfin1 binding consensus sequence. The results show unambiguously binding specificity of Alfin1 DNA, supporting its role in gene regulation. Alfin1 function was tested in transformed alfalfa in vivo by over-expressing Alfin1 from 35S CaMV promoter. The transgenic plants appeared normal. However, plants harboring the anti-sense construct did not grow well in soil, indicating that Alfin1 expression was essential. Alfin1 over-expression in transgenic alfalfa led to enhanced levels of MsPRP2 transcript accumulation, demonstrating that Alfin1 functioned in vivo in gene regulation. Since MsPRP2 gene is also induced by salt, it is likely that Alfin1 is an important transcription factor for gene regulation in salt-tolerant alfalfa, and an excellent target for manipulation to improve salt tolerance. (author)

Role of Silver Salts Lattice Energy on Conductivity Drops in Chitosan Based Solid Electrolyte: Structural, Morphological and Electrical Characteristics

Science.gov (United States)

Aziz, Shujahadeen B.; Abdullah, Omed Gh.; Hussein, Sarkawt A.

2018-03-01

The influence of anion type on silver ion reduction and drop in direct current (DC) conductivity was investigated experimentally. The structural, optical, morphological and electrical properties of the samples were investigated using x-ray diffraction (XRD), ultraviolet-visible (UV-Vis), optical micrographs (OM) and impedance spectroscopy. The XRD results reveal significant disruption in the crystalline structure of chitosan (CS) for different concentrations of silver nitrate (AgNt) salt. The localized surface resonance plasmonic (LSRP) peaks that were observed for CS:AgNt samples, along with the white silver specs detected by OM technique confirm the formation of Ag nanoparticles. The appearance of obvious dark regions in the CS:AgNt system reveals the existence of a large percentage of amorphous domains. The nonexistence of spherulitic texture confirms the amorphous nature of the samples. The second semicircle in an impedance plot can be attributed to an Ag nanoparticle grain boundary. The established relationships between dielectric constant and carrier concentration and the behavior of dielectric constant versus salt concentration were used to explain the phenomenon of ion-ion association. The continuous increase of DC conductivity was noticed at high temperatures, which was then explained on the basis of lattice energy of silver salts. The influences of anion size on the rate of silver ion reductions are also interpreted.

Pressure-induced structural transformations in the molybdate Sc-2(MoO4)(3)

DEFF Research Database (Denmark)

Paraguassu, W.; Maczka, M.; Filho, A. G. Sonza

2004-01-01

High pressure Raman scattering and x-ray diffraction studies of the molybdate Sc-2(MoO4)(3) are presented. A sequence of changing symmetry effects is observed through two structural phase transitions ending up with an amorphous state. The observed two structural phase transformations are reversible...

Ionic structure of solutions of alkali metals and molten salts

International Nuclear Information System (INIS)

Chabrier, G.; Senatore, G.; Tosi, M.P.

1982-02-01

Neutron diffraction patterns from K-KCl and Rb-RbBr liquid solutions at various compositions are examined in an ionic-mixture model which neglects screening and aggregation due to the metallic electrons. The main feature of the observed diffraction patterns for wave number k above roughly 1A -1 are accounted for by the model. The approach to the metal-rich end of the phase diagram is analyzed in detail from different viewpoints in the K-KCl system. Short-range correlations of the potassium ions are described in this region by a metallic radius deduced from properties of the pure liquid metal, but a simple expanded-metal model must be supplemented by the assumption that considerable disorder is introduced in its structure by the halogen ions. Features of short-range ordering in the salt-rich region that are implied by a shoulder on the high-k side of the main peak in the diffraction pattern are also commented upon. (author)

Examination of Below-Ground Structure and Soil Respiration Rates of Stable and Deteriorating Salt Marshes in Jamaica Bay (NY)

Science.gov (United States)

CAT scan imaging is currently being used to examine below-ground peat and root structure in cores collected from salt marshes of Jamaica Bay, part of the Gateway National Recreation Area (NY). CAT scans or Computer-Aided Tomography scans use X-ray equipment to produce multiple i...

A way to limit the corrosion in the Molten Salt Reactor concept: the salt redox potential control

International Nuclear Information System (INIS)

Gibilaro, M.; Massot, L.; Chamelot, P.

2015-01-01

The possibility of controlling the salt redox potential thanks to a redox buffer in the Molten Salt Fast Reactor was investigated, the goal was to limit the oxidation of the reactor structural material. Tests were performed in LiF-CaF 2 at 850 °C on two different redox couples to fix the salt potential, Eu(III)/Eu(II) and U(IV)/U(III), where the first one was used as inactive system to validate the methodology to be applied on the uranium system. A metallic reducing agent (Gd plate for Eu, and U plate for U system) was inserted in the salt, leading to a spontaneous reaction: Eu(III) and U(IV) were then reduced. Eu(III) was fully converted into Eu(II) with metallic Gd, validating the approach. On the U system, the U(IV)/U(III) ratio has to be set between 10 and 100 to limit the core material oxidation: addition of metallic U decreased the concentration ratio from the infinite to 1, showing the feasibility of the salt redox potential control with the U system

Deracemization of Axially Chiral Nicotinamides by Dynamic Salt Formation with Enantiopure Dibenzoyltartaric Acid (DBTA

Directory of Open Access Journals (Sweden)

Fumitoshi Yagishita

2013-11-01

Full Text Available Dynamic atroposelective resolution of chiral salts derived from oily racemic nicotinamides and enantiopure dibenzoyltartaric acid (DBTA was achieved by crystallization. The absolute structures of the axial chiral nicotinamides were determined by X-ray structural analysis. The chirality could be controlled by the selection of enantiopure DBTA as a chiral auxiliary. The axial chirality generated by dynamic salt formation was retained for a long period after dissolving the chiral salt in solution even after removal of the chiral acid. The rate of racemization of nicotinamides could be controlled based on the temperature and solvent properties, and that of the salts was prolonged compared to free nicotinamides, as the molecular structure of the pyridinium ion in the salts was different from that of acid-free nicotinamides.

Evidence of sealing and brine distribution at grain boundaries in natural fine-grained Halite (Qum Kuh salt fountain, Central Iran): implications for rheology of salt extrusions

Science.gov (United States)

Desbois, Guillaume; Urai, Janos L.; de Bresser, J. H. P.

2010-05-01

When grain boundary movement is stopped, surface energy related forces reassert themselves driving the system to its equilibrium conditions ([2], [6], [7], [8]). This could result in growth of islands and shrinking of channels and hence in healing the boundary by internal redistribution of fluid and solid in the contact region. Such islands are proposed to grow preferentially close to the contact rim and promote the healing of the grain-grain contact, which in turn prevents transport in or out the boundary region and thus traps the fluids in isolated inclusions. This contribution is focused on observation of grain boundary microstructures in natural mylonitic rocksalt collected from the distal part of Kum-Quh salt fountain (central Iran) in order to give unprecedented insight of grain boundary microstructures using argon-beam cross-sectioning to prepare high quality polished surfaces suitable for high-resolution SEM imaging. The possibility to use our SEM under cryogenic conditions allows also imaging the in-situ distribution of fluids. Results show that brine at grain boundaries occurs as thick layers (> µm in scale) corresponding to cross-sectioned wetted triple junction tubes, as filling at triple junction and as array of isolated fluids inclusions at grain-grain contacts. Close observations at islands contacts suggest the presence of a very thin fluid film (Journal of Structural Geology. [2] Ghoussoub J., and Leroy Y.M. (2001), Solid-fluid phase transformation within grain boundaries during compaction by pressure solution, J. Mech. Phys. Solids, 49, 737 2385-2430. 738 [3] Jackson, M.P.A., (1985). Natural strain in diapiric and glacial rock salt, with emphasis on Oakwood dome, East Texas, Bureau of Economic Geology, The University of Texas at Austin, Texas. [4] Schléder Z. and Urai J.L. (2007). Deformation and recrystallization mechanisms in mylonitic shear zones in naturally deformed extrusive Eocene-Oligocene rock salt from Eyvanekey plateau and Garmsar

Q-mode curve resolution of UV-vis spectra for structural transformation studies of anthocyanins in acidic solutions

Energy Technology Data Exchange (ETDEWEB)

Marco, Paulo Henrique [Laboratorio de Quimiometria em Ciencias Naturais, Departamento de Quimica, Universidade Estadual de Londrina, Caixa Postal 6001, CEP 86051-970 Londrina, Parana (Brazil); Scarminio, Ieda Spacino [Laboratorio de Quimiometria em Ciencias Naturais, Departamento de Quimica, Universidade Estadual de Londrina, Caixa Postal 6001, CEP 86051-970 Londrina, Parana (Brazil)]. E-mail: ieda@qui.uel.br

2007-01-30

Chemometric analysis of ultraviolet-visible (UV-vis) spectra for pH values 1.0, 3.3, 5.3, and 6.9 was used to investigate the kinetics and the structural transformations of anthocyanins in extracts of calyces of hibiscus flowers of the Hibiscus acetosella Welw. ex Finicius for the first time. Six different species were detected: the quinoidal base (A), the flavylium cation (AH{sup +}), the pseudobase or carbinol pseudobase (B), cis-chalcone (C{sub C}), trans-chalcone (C{sub t}), and ionized cis-chalcone (C{sub C}{sup -}). Four equilibrium constant values were calculated using relative concentrations, hydration, pK{sub h}=2.60+/-0.01, tautomeric, K{sub T}=0.14+/-0.01, acid-base, pK{sub a}=4.24+/-0.04, and ionization of the cis-chalcone, pK{sub C{sub C}}=8.74+/-1.5x10{sup -2}. The calculated protonation rate of the tautomers is K{sub H{sup +}}=0.08+/-7.6x10{sup -3}. These constants are in excellent agreement with those measured previously in salt form. From a kinetic viewpoint, the situation encountered is interesting since the reported investigation is limited to visible light absorption in acid medium. These models have not been reported in the literature.

Soluble salts: their incidence on the protection of metallic structures by paint coatings

International Nuclear Information System (INIS)

Morcillo, M.

2003-01-01

The presence of soluble salts at the metal/paint interface is known to have a detrimental effect on the integrity of most paint systems. Though this is a long-standing problem, it has recently come to receive greater attention from the protective coatings industry. In the paper the following points are reviewed: degradation mechanisms of the metal/paint system, the role of the metallic substrate, the nature, origin and detection os soluble salts, expected levels of soluble salts in practice, critical thresholds of soluble salts and risk levels for premature failures, role of the type and thickness of paint systems and exposure conditions, and prevention measures. The author presents an overview of the subject, making reference to the related research that has been carried out by him and his co-workers over the last 16 years. (Author) 58 refs

4D modeling of salt-sediment interactions during diapir evolution

Energy Technology Data Exchange (ETDEWEB)

Callot, J.P.; Rondon, D.; Letouzey, J. [IFP, Rueil Malmaison (France); Krajewski, P. [Gaz de France-PEG, Lingen (Germany); Rigollet, C. [Gaz de France, St. Denis la Plaine (France)

2007-09-13

We performed sand/silicon models imaged with X-ray tomography and reconstructed by 3D geomodelling for the study of (1) the interaction between host rock and salt diapir during diapir growth, and (2) the evolution of intra salt brittle rocks during diapir ascent. X-ray tomography is a non destructive imaging technique which allows us to follow the 4D evolution of the analogue model. Salt is modelled by Newtonian silicone putty and the internal rock layer, as well as the sedimentary host rock, by a granular Mohr-Coulomb material, generally coryndon. The analogue models are then compared to natural examples, the evolution of which is obtained through 3D restoration of the structures. (1) A 4D evolutionary scenario for a salt diapir development was originally proposed by Trusheim (1960) and discussed later on by Vendeville (1999) among others (Ge et al., 1997; Zirngast et al., 1996). This scenario is reproduced through analogue models to test the relative importance of (1) extensional tectonics, (2) sediment progradations, and (3) source layer depletion and rim-syncline touchdown, in the evolution of a diapir. The comparison of our results with the restored natural analogue shows that the main parameter remains (1) the rim-syncline touchdown and (2) the unloading of the diapir due to erosion. The latter accounts for a drop in strength necessary to allow for the flank rotation and down building of the diapir. Extensional stresses and sediment progradations will also amplify the halokinesis. (2) Salt diapirs from the Middle East or in Southern Permian Basin petroleum province show exotic blocks at outcrop and in salt mines, known as 'stringers' in subsurface data, usually composed of anhydrite, dolomite, marls or carbonates. These stringers, which constitute major structures inside the salt diapir, can reach a few km in size and originate from pre-existing brittle rock layers embedded in the salt layer. Stringers of the Ara carbonate within the Precambrian

Metallic conductivity in a disordered charge-transfer salt derived from cis-BET-TTF

Energy Technology Data Exchange (ETDEWEB)

Rovira, C. [Inst. de Ciencia de Materials de Barcelona (CSIC) (Spain); Tarres, J. [Inst. de Ciencia de Materials de Barcelona (CSIC) (Spain); Ribera, E. [Inst. de Ciencia de Materials de Barcelona (CSIC) (Spain); Veciana, J. [Inst. de Ciencia de Materials de Barcelona (CSIC) (Spain); Canadell, E. [Inst. de Ciencia de Materials de Barcelona (CSIC) (Spain); Molins, E. [Inst. de Ciencia de Materials de Barcelona (CSIC) (Spain); Mas, M. [Inst. de Ciencia de Materials de Barcelona (CSIC) (Spain); Laukhin, V. [Inst. de Ciencia de Materials de Barcelona (CSIC) (Spain)]|[Rossijskaya Akademiya Nauk, Chernogolovka (Russian Federation). Inst. Khimicheskoj Fiziki; Doublet, M.L. [Lab. de Structure et Dynamique (CNRS), Univ. de Montpellier 2 (France); Cowan, D.O. [Johns Hopkins Univ., Baltimore, MD (United States). Dept. of Chemistry; Yang, S. [Johns Hopkins Univ., Baltimore, MD (United States). Dept. of Chemistry

1997-02-28

The first example of a metallic charge-transfer salt derived from cis-bis(ethylenethio)-tetrathiafulvalene (BET-TTF) is reported. (BET-TTF){sub 2}SCN and (BET-TTF)SCN salts were obtained by electrocrystallization starting from trans-BET-TTF. X-ray crystal structure of the mixed-valence salt revealed that trans-cis isomerization occurs upon one electron oxidation. In spite of the structural disorder in both BET-TTF and the counterion, 2:1 salt is metallic down to 60 K and then resistance increases slowly down to 4 K. (orig.)

21 CFR 100.155 - Salt and iodized salt.

Science.gov (United States)

2010-04-01

... 21 Food and Drugs 2 2010-04-01 2010-04-01 false Salt and iodized salt. 100.155 Section 100.155 Food and Drugs FOOD AND DRUG ADMINISTRATION, DEPARTMENT OF HEALTH AND HUMAN SERVICES (CONTINUED) FOOD FOR HUMAN CONSUMPTION GENERAL Specific Administrative Rulings and Decisions § 100.155 Salt and iodized salt. (a) For the purposes of this section, the...

Synthesis and characterization of JBW structure and its thermal transformation

International Nuclear Information System (INIS)

Hegazy, Eman Z.; Kosa, Samia A.; Abd El Maksod, Islam Hamdy

2012-01-01

In this paper, JBW zeolite prepared from Egyptian kaolin was investigated by means of XRD, IR, SEM, EDX and ion exchange of some heavy metals. Adsorption isotherms were used to investigate the structure and properties of the prepared zeolite. XRD analysis showed that the JBW was a pure crystalline phase with orthorhombic crystal symmetry. Thermal treatment showed that the JBW transformed into the It-Carn phase at 1000 °C through an intermediate crystalline alumino silicate phase. SEM images showed that the JBW crystallised in a cylindrical shape. However, spherical agglomerates were observed at lower magnifications. The ion exchange isotherms with Cu 2+ , Ni 2+ and Co 2+ were found to follow a Freundlich isotherm. In addition, it shows higher affinity towards Cu 2+ than other ions. - Graphical abstract: JBW zeolite structure was prepared from Egyptian kaolin and characterised. XRD analysis showed that the JBW was a pure crystalline phase with orthorhombic crystal symmetry. Thermal treatment showed that the JBW transformed into the It-Carn phase at 1000 °C through an intermediate crystalline alumino silicate phase. Highlights: ► Egyptian kaolin was successfully used to prepare pure phase of JBW Structure. ► JBW is stable till 2+ , Ni 2+ , and Co 2+ followed up Freundlich isotherm. ► Selectivity towards Cu 2+ is much higher than Co 2+ or Ni 2+ .

Simulation of salt behavior using in situ response

International Nuclear Information System (INIS)

Li, W.T.

1986-01-01

The time-dependent nonlinear structural behavior in a salt formation around the openings can be obtained by either performing computational analysis of measuring in situ responses. However, analysis using laboratory test data may often deviate from the actual in situ conditions and geomechanical instruments can provide information only up to the time when the measurements were taken. A method has been suggested for simulating the salt behavior by utilizing the steady-state portion of in situ response history. Governing equations for computational analysis were normalized to the creep constant, the equations were solved, and the analytical response history was then computed in terms of normalized time. By synchronizing the response history obtained from the analysis to the one measured at the site, the creep constant was determined. Then the structural response of the salt was computed. This paper presents an improved method for simulating the salt behavior. In this method, the governing equations are normalized to the creep function, which represents the transient and the steady-state creep behavior. Both the transient and the steady-state portions of in situ response history are used in determining the creep function. Finally, a nonlinear mapping process relating the normalized and real time domains determines the behavior of the salt

Toxicity of road salt to Nova Scotia amphibians

International Nuclear Information System (INIS)

Collins, Sara J.; Russell, Ronald W.

2009-01-01

The deposition of chemical pollutants into roadside wetlands from runoff is a current environmental concern. In northern latitudes, a major pollutant in runoff water is salt (NaCl), used as de-icing agents. In this study, 26 roadside ponds were surveyed for amphibian species richness and chloride concentration. Acute toxicity tests (LC 50 ) were performed on five locally common amphibian species using a range of environmentally significant NaCl concentrations. Field surveys indicated that spotted salamanders (Ambystoma maculatum) and wood frogs (Rana sylvatica) did not occupy high chloride ponds. American toads (Bufo americanus) showed no pond preference based on chloride concentration. Acute toxicity tests showed spotted salamanders and wood frogs were most sensitive to chloride, and American toads were the least. Spring peepers (Pseudacris crucifer) and green frogs (Rana clamitans) showed intermediate sensitivities. We concluded that chloride concentrations in ponds due to application of de-icing salts, influenced community structure by excluding salt intolerant species. - Salt toxicity is presented as a mechanism affecting the distribution of amphibians and structure of amphibian communities in roadside wetlands

Transformation Education: A Vehicle for Structuring Group Care Organizations to Increase Service Quality and Effectiveness

Science.gov (United States)

Ross, Andrew L.

2007-01-01

Transformation Education, an organizational philosophy and operating system, is designed to increase service quality and effectiveness of group care through aligning its organizational structure with its purpose. This alignment is achieved through creating a culture designed to dispense transformation rather than treatment. The author presents how…

Molten salt fueled nuclear facility with steam-and gas turbine cycles of heat transformation

International Nuclear Information System (INIS)

Ananich, P.I.; Bunin, E.N.; Kazazyan, V.T.; Nemtsev, V.A.; Sikorin, S.N.

2001-01-01

The molten salt fueled nuclear facilities with fuel circulating in the primary circuit have a series of the potential advantages in comparison with the traditional thermal and fast reactors with solid fuel elements. These advantages are ensured by the possibility to receive effective neutron balance in the core, minimum margin reactivity, more deep fuel burnup, unbroken correctness of the fuel physical and chemical properties and by low prices of the fuel cycle. The neutron and thermal-physical calculations of the various variants of the MSFNF with steam-water and gas turbine power circuits and their technical and economical comparison are carried out in this article. Calculations of molten salt nuclear power plant with gas turbine power circuit have been carried out using chemically reacting working body ''nitrin'' (N304 + 1%NO). The molten salt fueled reactors with the thermal power near of 2300 MW with two fuel compositions have been considered. The base variant has been taken the design of NPP with VVER NP-1000 when comparing the results of the calculations. Its economical performances are presented in prices of 1990. The results of the calculations show that it is difficult to determine the advantages of any one of the variants considered in a unique fashion. But NPP with MSR possesses large reserves in the process of optimization of cycle and energy equipment parameters that can improve its technical and economical performances sufficiently. (author)

Study on the phosphate reaction characteristics of lanthanide chlorides in molten salt with operating conditions

International Nuclear Information System (INIS)

Lee, Tae-Kyo; Hwang, Taek-Sung; Cho, Yung-Zun; Eun, Hee-Chul; Park, Hwan-Seo; Park, Geun-Il; Son, Sung-Mo

2013-01-01

A minimization of waste salt is one of the most important issues for the optimization of pyroprocessing. The separation of fission products in waste salts and the reuse of purified waste salt are promising strategies for minimizing the waste salt amounts. The phosphate precipitation of lanthanide is currently being considered for eutectic (LiCl–KCl) waste salt purification. In this research, the effects of molten salt temperature (400–550°C) and reaction time (max. 180 min) upon conversion into the phosphate of lanthanides was investigated using 1 and 3 kg of eutectic salt. The conversion efficiency of lanthanides to molten salt-insoluble precipitates and phosphates was increased with an increase in molten salt temperature and operating time until it attained a specific temperature and time. K 3 PO 4 as a precipitant was more favorable than Li 3 PO 4 in terms of reactivity. To obtain over a 99% overall conversion efficiency, about 30 min was required in the case of using K 3 PO 4 at 450°C, but about 120 min in the case of using Li 3 PO 4 at 550°C. The lanthanide precipitates formed by a reaction with phosphate were a mixture of monoclinic structures, usually representing a polyhedron structure, and a tetragonal structure, representing a platelet structure. (author)

Hydrogeological research at the site of the Asse salt mine

International Nuclear Information System (INIS)

Batsche, H.; Rauert, W.; Klarr, K.

1980-01-01

In connection with the storage of radioactive wastes in the abandoned Asse salt mine near Brunswick (Federal Republic of Germany), the hydrogeology of the ridge of hills of Asse has been investigated. In order to obtain as detailed information as possible on the hydrogeological conditions, a long-term investigation programme has been set up and many methods of investigation have been used. Hydrogeological boring operations resulted in important scientific findings regarding, for example, the course of the salt table and the main anhydrite which towers up above the salt table into the overlying collapsed rocks. Hydrochemical data showed the hydraulic effect of transverse faults. Isotopic hydrological measurements permitted distinction between the flow behaviour of the groundwater in different aquifers. The origin of the salt springs at the northwest end of the structure can be explained. Some additional pumping and labelling tests are expected to yield quantitative results concerning hydraulic interrelationships recognized to date. The very complex hydrogeological structure of the ridge of hills of Asse is the result of the multiple succession of permeable and impermeable layers on the flanks of the structure, and, furthermore, is possibly due to the fact that in some individual faults groundwater may seep through normally impermeable layers as well as via waterways at the salt table. (author)

Preparation of an amorphous sodium furosemide salt improves solubility and dissolution rate and leads to a faster Tmax after oral dosing to rats

DEFF Research Database (Denmark)

Nielsen, Line Hagner; Gordon, Sarah; Holm, René

2013-01-01

Amorphous forms of furosemide sodium salt and furosemide free acid were prepared by spray drying. For the preparation of the amorphous free acid, methanol was utilised as the solvent, whereas the amorphous sodium salt was formed from a sodium hydroxide-containing aqueous solvent in equimolar...... amounts of NaOH and furosemide. Information about the structural differences between the two amorphous forms was obtained by Fourier Transform Infrared Spectroscopy (FTIR), and glass transition temperature (Tg) was determined using Differential Scanning Calorimetry (DSC). The stability and devitrification...... tendency of the two amorphous forms were investigated by X-ray Powder Diffraction (XRPD). The apparent solubility of the two amorphous forms and the crystalline free acid form of furosemide in various gastric and intestinal stimulated media was determined. Moreover, the dissolution characteristics...

M(II)-dipyridylamide-based coordination frameworks (M=Mn, Co, Ni): Structural transformation

Energy Technology Data Exchange (ETDEWEB)

Tzeng, Biing-Chiau; Selvam, TamilSelvi; Tsai, Miao-Hsin

2016-11-15

A series of 1-D double-zigzag (([M(papx){sub 2}(H{sub 2}O){sub 2}](ClO{sub 4}){sub 2}){sub n}; M=Mn, x=s (1), x=o (3); M=Co, x=s (4), x=o (5); M=Ni, x=s (6), x=o (7)) and 2-D polyrotaxane ([Mn(paps){sub 2}(ClO{sub 4}){sub 2}]{sub n} (2)) frameworks were synthesized by reactions of M(ClO{sub 4}){sub 2} (M=Mn, Co, and Ni) with papx (paps, N,N’-bis(pyridylcarbonyl)-4,4’-diaminodiphenylthioether; papo, N,N’-bis(pyridylcarbonyl)-4,4’-diaminodiphenyl ether), which have been isolated and structurally characterized by X-ray diffraction. Based on powder X-ray diffraction (PXRD) experiments, heating the double-zigzag frameworks underwent structural transformation to give the respective polyrotaxane ones. Moreover, grinding the solid samples of the respective polyrotaxanes in the presence of moisture also resulted in the total conversion to the original double-zigzag frameworks. In this study, we have successfully extended studies to Mn{sup II}, Co{sup II}, and Ni{sup II} frameworks from the previous Zn{sup II}, Cd{sup II}, and Cu{sup II} ones, and interestingly such structural transformation is able to be proven experimentally by powder and single-crystal X-ray diffraction studies as well. - Graphical abstract: 1-D double-zigzag and 2-D polyrotaxane frameworks of M(II)-papx (x=s, o; M=Mn, Co, Ni) frameworks can be interconverted by heating and grinding in the presence of moiture, and such structural transformation has be proven experimentally by powder and single-crystal X-ray diffraction studies.

Experiments and Modeling in Support of Generic Salt Repository Science

International Nuclear Information System (INIS)

Bourret, Suzanne Michelle; Stauffer, Philip H.; Weaver, Douglas James; Caporuscio, Florie Andre; Otto, Shawn; Boukhalfa, Hakim; Jordan, Amy B.; Chu, Shaoping; Zyvoloski, George Anthony; Johnson, Peter Jacob

2017-01-01

Salt is an attractive material for the disposition of heat generating nuclear waste (HGNW) because of its self-sealing, viscoplastic, and reconsolidation properties (Hansen and Leigh, 2012). The rate at which salt consolidates and the properties of the consolidated salt depend on the composition of the salt, including its content in accessory minerals and moisture, and the temperature under which consolidation occurs. Physicochemical processes, such as mineral hydration/dehydration salt dissolution and precipitation play a significant role in defining the rate of salt structure changes. Understanding the behavior of these complex processes is paramount when considering safe design for disposal of heat-generating nuclear waste (HGNW) in salt formations, so experimentation and modeling is underway to characterize these processes. This report presents experiments and simulations in support of the DOE-NE Used Fuel Disposition Campaign (UFDC) for development of drift-scale, in-situ field testing of HGNW in salt formations.

Experiments and Modeling in Support of Generic Salt Repository Science

Energy Technology Data Exchange (ETDEWEB)

Bourret, Suzanne Michelle [Los Alamos National Lab. (LANL), Los Alamos, NM (United States); Stauffer, Philip H. [Los Alamos National Lab. (LANL), Los Alamos, NM (United States); Weaver, Douglas James [Los Alamos National Lab. (LANL), Los Alamos, NM (United States); Caporuscio, Florie Andre [Los Alamos National Lab. (LANL), Los Alamos, NM (United States); Otto, Shawn [Los Alamos National Lab. (LANL), Los Alamos, NM (United States); Boukhalfa, Hakim [Los Alamos National Lab. (LANL), Los Alamos, NM (United States); Jordan, Amy B. [Los Alamos National Lab. (LANL), Los Alamos, NM (United States); Chu, Shaoping [Los Alamos National Lab. (LANL), Los Alamos, NM (United States); Zyvoloski, George Anthony [Los Alamos National Lab. (LANL), Los Alamos, NM (United States); Johnson, Peter Jacob [Los Alamos National Lab. (LANL), Los Alamos, NM (United States)

2017-01-19

Salt is an attractive material for the disposition of heat generating nuclear waste (HGNW) because of its self-sealing, viscoplastic, and reconsolidation properties (Hansen and Leigh, 2012). The rate at which salt consolidates and the properties of the consolidated salt depend on the composition of the salt, including its content in accessory minerals and moisture, and the temperature under which consolidation occurs. Physicochemical processes, such as mineral hydration/dehydration salt dissolution and precipitation play a significant role in defining the rate of salt structure changes. Understanding the behavior of these complex processes is paramount when considering safe design for disposal of heat-generating nuclear waste (HGNW) in salt formations, so experimentation and modeling is underway to characterize these processes. This report presents experiments and simulations in support of the DOE-NE Used Fuel Disposition Campaign (UFDC) for development of drift-scale, in-situ field testing of HGNW in salt formations.

Activity and conformation of lysozyme in molecular solvents, protic ionic liquids (PILs) and salt-water systems.

Science.gov (United States)

Wijaya, Emmy C; Separovic, Frances; Drummond, Calum J; Greaves, Tamar L

2016-09-21

Improving protein stabilisation is important for the further development of many applications in the pharmaceutical, specialty chemical, consumer product and agricultural sectors. However, protein stabilization is highly dependent on the solvent environment and, hence, it is very complex to tailor protein-solvent combinations for stable protein maintenance. Understanding solvent features that govern protein stabilization will enable selection or design of suitable media with favourable solution environments to retain protein native conformation. In this work the structural conformation and activity of lysozyme in 29 solvent systems were investigated to determine the role of various solvent features on the stability of the enzyme. The solvent systems consisted of 19 low molecular weight polar solvents and 4 protic ionic liquids (PILs), both at different water content levels, and 6 aqueous salt solutions. Small angle X-ray scattering, Fourier transform infrared spectroscopy and UV-vis spectroscopy were used to investigate the tertiary and secondary structure of lysozyme along with the corresponding activity in various solvation systems. At low non-aqueous solvent concentrations (high water content), the presence of solvents and salts generally maintained lysozyme in its native structure and enhanced its activity. Due to the presence of a net surface charge on lysozyme, electrostatic interactions in PIL-water systems and salt solutions enhanced lysozyme activity more than the specific hydrogen-bond interactions present in non-ionic molecular solvents. At higher solvent concentrations (lower water content), solvents with a propensity to exhibit the solvophobic effect, analogous to the hydrophobic effect in water, retained lysozyme native conformation and activity. This solvophobic effect was observed particularly for solvents which contained hydroxyl moieties. Preferential solvophobic effects along with bulky chemical structures were postulated to result in less

Some aspects of the development of NW-German salt domes

International Nuclear Information System (INIS)

Jaritz, W.

1980-01-01

Aspects of the development of salt structures that may be of some importance to the safety of a final disposal site for radioactive waste are salt ascent and salt dissolution at the surface. The geological history of the salt domes is described in terms of the dissolution of the salt at the dome surface. In many cases it can be distinguished whether dissolution was caused by the ascent of the salt into strata containing groundwater by diapirism or by epeirogenic uplift or both. The salt domes of Wesendorf, Heide, and Marne are used as examples in a discussion of the transition from dissolution to the deposition of a cover of impermeable sediments. Moreover, the development of the Gorleben salt dome is described. The author's studies show the average rate of uplift of the NW-German salt domes in the diapiric stage to have ranged from a little less than 0.1 to about 0.5 mm per year. For salt domes in later stages, the rate of uplift is several hundredths of a millimeter per year at most. (orig.) [de

Internal friction behaviors of Ni-Mn-In magnetic shape memory alloy with two-step structural transformation

Directory of Open Access Journals (Sweden)

Zhen-ni Zhou

2017-06-01

Full Text Available The internal friction (IF behaviors of dual-phase Ni52Mn32In16 alloy with two-step structural transformation were investigated by dynamic mechanical analyzer. The IF peak for the martensite transformation (MT is an asymmetric shoulder rather than those sharp peaks for other shape memory alloys. The intermartensitic transformation (IMT peak has the maximum IF value. As the heating rate increases, the height of the IMT peak increases and its position is shifted to higher temperatures. In comparison with the IMT peak, the MT peak is independent on the heating rate. The starting temperatures of the IMT peak are strongly dependent on frequency, while the MT peak is weakly dependent. Meanwhile, the heights of both the MT and IMT peak rapidly decrease with increasing the frequency. This work also throws new light on their structural transformation mechanisms.

Technology for Salt Production in the Mixteca Alta

Directory of Open Access Journals (Sweden)

Ricardo Antonio León Hernández

2015-01-01

Full Text Available Salt production in the Mixteca Alta is a traditional means of production from prehispanic period, which, despite the economic transformation processes in the colonial period, remained significant features of the traditional process, based on the documented similar models from other productive regions in Mexico. The salt in the novohispanic period was considered a major consumption economic asset due to its use in production processes for the production of new economic products that supported the economy of preindustrial societies (Terán, 2011, p. 71; Williams, 2008. Technology refers to the knowledges for solving human needs arising lifestyle of the cultural groups that develop them. The resources of the natural environment underpin the means of labor that man requires to perform its activities, including economic. The means of production and production processes are technological developments, which involve elements of tangible and intangible order. The study of work processes for salt extraction, are significantly related to the processes of technological evolution that man has developed for the use of natural resources. The economic activities of the primary sector are examples of how humans culturally and economically were inserted in the natural environment (Malpica, 2008, p. 59. This analysis presents a historiographical approach to the study of the processes and the technology required for the extraction of salt in the Mixteca Alta.

Plant-based food and feed protein structure changes induced by gene-transformation, heating and bio-ethanol processing: a synchrotron-based molecular structure and nutrition research program.

Science.gov (United States)

Yu, Peiqiang

2010-11-01

Unlike traditional "wet" analytical methods which during processing for analysis often result in destruction or alteration of the intrinsic protein structures, advanced synchrotron radiation-based Fourier transform infrared microspectroscopy has been developed as a rapid and nondestructive and bioanalytical technique. This cutting-edge synchrotron-based bioanalytical technology, taking advantages of synchrotron light brightness (million times brighter than sun), is capable of exploring the molecular chemistry or structure of a biological tissue without destruction inherent structures at ultra-spatial resolutions. In this article, a novel approach is introduced to show the potential of the advanced synchrotron-based analytical technology, which can be used to study plant-based food or feed protein molecular structure in relation to nutrient utilization and availability. Recent progress was reported on using synchrotron-based bioanalytical technique synchrotron radiation-based Fourier transform infrared microspectroscopy and diffused reflectance infrared Fourier transform spectroscopy to detect the effects of gene-transformation (Application 1), autoclaving (Application 2), and bio-ethanol processing (Application 3) on plant-based food and feed protein structure changes on a molecular basis. The synchrotron-based technology provides a new approach for plant-based protein structure research at ultra-spatial resolutions at cellular and molecular levels.

Geologic appraisal of Paradox basin salt deposits for water emplacement

Science.gov (United States)

Hite, Robert J.; Lohman, Stanley William

1973-01-01

Thick salt deposits of Middle Pennsylvanian age are present in an area of 12,000 square miles in the Paradox basin of southeast Utah and southwest Colorado. The deposits are in the Paradox Member of the Hermosa Formation. The greatest thickness of this evaporite sequence is in a troughlike depression adjacent to the Uncompahgre uplift on the northeast side of the basin.The salt deposits consist of a cyclical sequence of thick halite units separated by thin units of black shale, dolomite, and anhydrite. Many halite units are several hundred feet thick and locally contain economically valuable potash deposits.Over much of the Paradox basin the salt deposits occur at depths of more than 5,000 feet. Only in a series of salt anticlines located along the northeastern side of the basin do the salt deposits rise to relatively shallow depths. The salt anticlines can be divided geographically and structurally into five major systems. Each system consists of a long undulating welt of thickened salt over which younger rocks are arched in anticlinal form. Locally there are areas along the axes of the anticlines where the Paradox Member was never covered by younger sediments. This allowed large-scale migration of Paradox strata toward and up through these holes in the sediment cover forming diapiric anticlines.The central or salt-bearing cores of the anticlines range in thickness from about 2,500 to 14,000 feet. Structure in the central core of the salt anticlines is the result of both regional-compression and flowage of the Paradox Member into the anticlines from adjacent synclines. Structure in the central cores of the salt anticlines ranges from relatively undeformed beds to complexly folded and faulted masses, in which stratigraphic continuity is undemonstrable.The presence of thick cap rock .over many of the salt anticlines is evidence of removal of large volumes of halite by groundwater. Available geologic and hydrologic information suggests that this is a relatively slow

A novel zinc-finger-like gene from Tamarix hispida is involved in salt and osmotic tolerance.

Science.gov (United States)

An, Yan; Wang, Yucheng; Lou, Lingling; Zheng, Tangchun; Qu, Guan-Zheng

2011-11-01

In the present study, a zinc-finger-like cDNA (ThZFL) was cloned from the Tamarix hispida. Northern blot analysis showed that the expression of ThZFL can be induced by salt, osmotic stress and ABA treatment. Overexpression of the ThZFL confers salt and osmotic stress tolerance in both yeast Saccharomyces cerevisiae and tobacco. Furthermore, MDA levels in ThZFL transformed tobacco were significantly decreased compared with control plants under salt and osmotic stress, suggesting ThZFL may confer stress tolerance by decreasing membrane lipid peroxidation. Subcellular localization analysis showed the ThZFL protein is localized in the cell wall. Our results indicated the ThZFL gene is an excellent candidate for genetic engineering to improve salt and osmotic tolerance in agricultural plants.

Radioactive waste isolation in salt: geochemistry of brine in rock salt in temperature gradients and gamma-radiation fields - a selective annotated bibliography

International Nuclear Information System (INIS)

Hull, A.B.; Williams, L.B.

1985-07-01

Evaluation of the extensive research concerning brine geochemistry and transport is critically important to successful exploitation of a salt formation for isolating high-level radioactive waste. This annotated bibliography has been compiled from documents considered to provide classic background material on the interactions between brine and rock salt, as well as the most important results from more recent research. Each summary elucidates the information or data most pertinent to situations encountered in siting, constructing, and operating a mined repository in salt for high-level radioactive waste. The research topics covered include the basic geology, depositional environment, mineralogy, and structure of evaporite and domal salts, as well as fluid inclusions, brine chemistry, thermal and gamma-radiation effects, radionuclide migration, and thermodynamic properties of salts and brines. 4 figs., 6 tabs

Radioactive waste isolation in salt: geochemistry of brine in rock salt in temperature gradients and gamma-radiation fields - a selective annotated bibliography

Energy Technology Data Exchange (ETDEWEB)

Hull, A.B.; Williams, L.B.

1985-07-01

Evaluation of the extensive research concerning brine geochemistry and transport is critically important to successful exploitation of a salt formation for isolating high-level radioactive waste. This annotated bibliography has been compiled from documents considered to provide classic background material on the interactions between brine and rock salt, as well as the most important results from more recent research. Each summary elucidates the information or data most pertinent to situations encountered in siting, constructing, and operating a mined repository in salt for high-level radioactive waste. The research topics covered include the basic geology, depositional environment, mineralogy, and structure of evaporite and domal salts, as well as fluid inclusions, brine chemistry, thermal and gamma-radiation effects, radionuclide migration, and thermodynamic properties of salts and brines. 4 figs., 6 tabs.

Salt effects on ionization equilibria of histidines in myoglobin.

Science.gov (United States)

Kao, Y H; Fitch, C A; Bhattacharya, S; Sarkisian, C J; Lecomte, J T; García-Moreno E, B

2000-09-01

The salt dependence of histidine pK(a) values in sperm whale and horse myoglobin and in histidine-containing peptides was measured by (1)H-NMR spectroscopy. Structure-based pK(a) calculations were performed with continuum methods to test their ability to capture the effects of solution conditions on pK(a) values. The measured pK(a) of most histidines, whether in the protein or in model compounds, increased by 0.3 pH units or more between 0.02 M and 1.5 M NaCl. In myoglobin two histidines (His(48) and His(36)) exhibited a shallower dependence than the average, and one (His(113)) showed a steeper dependence. The (1)H-NMR data suggested that the salt dependence of histidine pK(a) values in the protein was determined primarily by the preferential stabilization of the charged form of histidine with increasing salt concentrations rather than by screening of electrostatic interactions. The magnitude and salt dependence of interactions between ionizable groups were exaggerated in pK(a) calculations with the finite-difference Poisson-Boltzmann method applied to a static structure, even when the protein interior was treated with arbitrarily high dielectric constants. Improvements in continuum methods for calculating salt effects on pK(a) values will require explicit consideration of the salt dependence of model compound pK(a) values used for reference in the calculations.

Rare earth and zinc layered hydroxide salts intercalated with the 2-aminobenzoate anion as organic luminescent sensitizer

International Nuclear Information System (INIS)

Cursino, Ana Cristina Trindade; Rives, Vicente; Arizaga, Gregorio Guadalupe Carbajal; Trujillano, Raquel; Wypych, Fernando

2015-01-01

Rare earth (RE = Eu, Y and Tb) and zinc layered hydroxide salts intercalated with nitrate anions were synthesized, followed by exchange with 2-aminobenzoate. The UV absorption ability was improved after intercalation/grafting in relation to that shown by the parent material. - Highlights: • Rare earth (RE = Eu, Y and Tb) and zinc layered hydroxide were synthesized. • Intercalated nitrate anions were exchanged by 2-aminobenzoate. • In all the 2-aminobenzoate containing compounds, the grafting reaction was detected. • The UV absorption ability was improved after the exchange reactions. • Rare earth hydroxide salts are potential matrixes to produce luminescent materials. - Abstract: Rare earth (RE = Eu, Y and Tb) and zinc layered hydroxide salts intercalated with nitrate anions were synthesized, followed by exchange with 2-aminobenzoate. The obtained compounds were characterized by powder X-ray diffraction (PXRD), Fourier transform infrared (FTIR) and ultraviolet visible (UV–vis) spectroscopies, fluorescence measurements and thermal analysis (TGA/DTA). The results from FTIR spectroscopy suggest a direct coordination of 2-aminobenzoate to the metal cations of the inorganic layered structure. The organic derivative products from the intercalation reactions absorb a broader range of UV-light in relation to that shown by the parent material; the photoluminescence measurements present a strong violet, blue and green luminescence under UV-light excitation for layered compounds with, Zn, Y and Tb, respectively. Rare earth hydroxide salts (RE-LHS) are potential alternative matrices for the immobilization of organic species to produce luminescent materials

Rare earth and zinc layered hydroxide salts intercalated with the 2-aminobenzoate anion as organic luminescent sensitizer

Energy Technology Data Exchange (ETDEWEB)

Cursino, Ana Cristina Trindade, E-mail: anacursino@ufpr.br [CEPESQ – Research Centre of Applied Chemistry, Department of Chemistry, Universidade Federal do Paraná – P.O. Box 19081, 81531-980 Curitiba, PR (Brazil); Rives, Vicente, E-mail: vrives@usal.es [GIR-QUESCAT – Department of Inorganic Chemistry, Universidad de Salamanca, Plaza de la Merced S/N, 37998 Salamanca (Spain); Arizaga, Gregorio Guadalupe Carbajal, E-mail: gregoriocarbajal@yahoo.com.mx [Universidad de Guadalajara, Department of Chemistry, Boulevard Marcelino García Barragán 1421, C.P. 44430 Guadalajara, Jalisco (Mexico); Trujillano, Raquel, E-mail: rakel@usal.es [GIR-QUESCAT – Department of Inorganic Chemistry, Universidad de Salamanca, Plaza de la Merced S/N, 37998 Salamanca (Spain); Wypych, Fernando, E-mail: wypych@ufpr.br [CEPESQ – Research Centre of Applied Chemistry, Department of Chemistry, Universidade Federal do Paraná – P.O. Box 19081, 81531-980 Curitiba, PR (Brazil)

2015-10-15

Rare earth (RE = Eu, Y and Tb) and zinc layered hydroxide salts intercalated with nitrate anions were synthesized, followed by exchange with 2-aminobenzoate. The UV absorption ability was improved after intercalation/grafting in relation to that shown by the parent material. - Highlights: • Rare earth (RE = Eu, Y and Tb) and zinc layered hydroxide were synthesized. • Intercalated nitrate anions were exchanged by 2-aminobenzoate. • In all the 2-aminobenzoate containing compounds, the grafting reaction was detected. • The UV absorption ability was improved after the exchange reactions. • Rare earth hydroxide salts are potential matrixes to produce luminescent materials. - Abstract: Rare earth (RE = Eu, Y and Tb) and zinc layered hydroxide salts intercalated with nitrate anions were synthesized, followed by exchange with 2-aminobenzoate. The obtained compounds were characterized by powder X-ray diffraction (PXRD), Fourier transform infrared (FTIR) and ultraviolet visible (UV–vis) spectroscopies, fluorescence measurements and thermal analysis (TGA/DTA). The results from FTIR spectroscopy suggest a direct coordination of 2-aminobenzoate to the metal cations of the inorganic layered structure. The organic derivative products from the intercalation reactions absorb a broader range of UV-light in relation to that shown by the parent material; the photoluminescence measurements present a strong violet, blue and green luminescence under UV-light excitation for layered compounds with, Zn, Y and Tb, respectively. Rare earth hydroxide salts (RE-LHS) are potential alternative matrices for the immobilization of organic species to produce luminescent materials.

Febuxostat-Minoxidil Salt Solvates: Crystal Structures, Characterization, Interconversion and Solubility Performance

Directory of Open Access Journals (Sweden)

Li-Yang Li

2018-02-01

Full Text Available Three febuxostat-minoxidil salt solvates with acetone (ACE, tetrahydrofuran (THF and isopropanol (IPA are synthesized by solvent-assisted grinding and characterized by infrared (IR, nuclear magnetic resonance (1H-NMR, single crystal and powder X-ray diffraction (PXRD, thermogravimetry (TG and differential scanning calorimetry (DSC. These febuxostat-minoxidil salt solvates feature isostructural with the same stoichiometries (1:1:1 molecule ratio. The proton transfers from the carboxylic group of febuxostat (FEB to imino N atom of minoxidil (MIN, which forms the motif with combined R 2 2 (9 R 4 2 (8 R 2 2 (9 graph set in the three solvates. The solvents occupy the different positions related to the motif, which results in the apparent differences in PXRD patterns before/after desolvation although they are isostructures. The FEB-MIN·THF was more thermostable than FEB-MIN·ACE and FEB-MIN·IPA relative to solvent removal from DSC patterns, which is different from the results from the solvent-exchange experiments in chemical kinetics. All three salt solvates exhibit increased equilibrium solubility compared to FEB in aqueous medium.

Synchrotron radiation : characteristics and application in structural studies and phase transformations of materials

International Nuclear Information System (INIS)

Craievich, A.F.

1984-01-01

The main characteristics of the synchrotron radiation for studying atomic structure and phase transformations in materials are presented. Some specific applications in alloys, glass and solids are described. (E.G.) [pt

Transform methods for precision continuum and control models of flexible space structures

Science.gov (United States)

Lupi, Victor D.; Turner, James D.; Chun, Hon M.

1991-01-01

An open loop optimal control algorithm is developed for general flexible structures, based on Laplace transform methods. A distributed parameter model of the structure is first presented, followed by a derivation of the optimal control algorithm. The control inputs are expressed in terms of their Fourier series expansions, so that a numerical solution can be easily obtained. The algorithm deals directly with the transcendental transfer functions from control inputs to outputs of interest, and structural deformation penalties, as well as penalties on control effort, are included in the formulation. The algorithm is applied to several structures of increasing complexity to show its generality.

Electronic structure and phase stability during martensitic transformation in Al-doped ZrCu intermetallics

International Nuclear Information System (INIS)

Qiu Feng; Shen Ping; Liu Tao; Lin Qiaoli; Jiang Qichuan

2010-01-01

Martensitic transformation, phase stability and electronic structure of Al-doped ZrCu intermetallics were investigated by experiments and first-principles calculations using the pseudopotentials plane wave method. The formation energy calculations indicate that the stability of the ZrCu phase increases with the increasing Al content. Al plays a decisive role in controlling the formation and microstructures of the martensite phases in Zr-Cu-Al alloys. The total energy difference between ZrCu (B2) austenite and ZrCu martensite plays an important role in the martensitic transformation. The phase stability is dependent on its electronic structure. The densities of states (DOS) of the intermetallics were discussed in detail.

STRUCTURE AND ORGANIZATION OF SHAPES IN THE DESIGN OF INDUSTRIAL PRODUCTS, USING GEOMETRICAL TRANSFORMATIONS

OpenAIRE

MARIN Dumitru

2006-01-01

This paper presents the major contribution of geometrical transformations in the structure and organization of the shapes which compose industrial products. Geometrical transformations, such as symmetry, translation, rotation, homology etc. are frequently used in the design activity for filling the plane and the space (plane and spatial equipartitions), in ornaments and also in creating shapes, which are functional and aesthetical at the same time.

Boric Ester-Type Molten Salt via Dehydrocoupling Reaction

Directory of Open Access Journals (Sweden)

Noriyoshi Matsumi

2014-11-01

Full Text Available Novel boric ester-type molten salt was prepared using 1-(2-hydroxyethyl-3-methylimidazolium chloride as a key starting material. After an ion exchange reaction of 1-(2-hydroxyethyl-3-methylimidazolium chloride with lithium (bis-(trifluoromethanesulfonyl imide (LiNTf2, the resulting 1-(2-hydroxyethyl-3-methylimidazolium NTf2 was reacted with 9-borabicyclo[3.3.1]nonane (9-BBN to give the desired boric ester-type molten salt in a moderate yield. The structure of the boric ester-type molten salt was supported by 1H-, 13C-, 11B- and 19F-NMR spectra. In the presence of two different kinds of lithium salts, the matrices showed an ionic conductivity in the range of 1.1 × 10−4–1.6 × 10−5 S cm−1 at 51 °C. This was higher than other organoboron molten salts ever reported.

Crystalline oxides on semiconductors: A structural transition of the interface phase

Science.gov (United States)

Walker, F. J.; Buongiorno-Nardelli, Marco; Billman, C. A.; McKee, R. A.

2004-03-01

The growth of crystalline oxides on silicon is facilitated by the preparation of a surface phase of alkaline earth silicide. We describe how the surface phase serves as a precursor of the final interface phase using reflection high energy electron diffraction (RHEED) and density functional theory (DFT). RHEED intensity oscillations of the growth of BaSrO show layer-by-layer build up of the oxide on the interface. The 2x1 symmetry of the surface precursor persists up to 3 ML BaSrO coverage at which point a 1x1 pattern characteristic of the rock-salt structure of BaSrO is observed. Prior to 3 ML growth of alkaline earth oxide, DFT calculations and RHEED show that the surface precursor persists as the interface phase and induces large displacements in the growing oxide layer away from the rock-salt structure and having a 2x1 symmetry. These distortions of the rock-salt structure are energetically unfavorable and become more unfavorable as the oxide thickness increases. At 3 ML, the stability of the rock-salt structure drives a structural transformation of the film and the interface phase to a structure that is distinct from the surface precursor. Research sponsored jointly by the Division of Materials Sciences and Engineering, Office of Basic Energy Sciences, U.S. Department of Energy at Oak Ridge National Laboratory under contract DE-AC05-00OR22725 with UT-Battelle, LLC and at the University of Tennessee under contract DE-FG02-01ER45937. Calculations have been performed on CCS supercomputers at Oak Ridge National Laboratory.

Preliminary investigation results as applied to utilization of Ukrainian salt formations for disposal of high-level radioactive waste

International Nuclear Information System (INIS)

Shekhunova, S.B.; Khrushchov, D.P.; Petrichenko, O.I.

1994-01-01

The salt-bearing formations have been investigated in five regions of Ukraine. Upper Devonian and Lower Permian evaporite formations in Dnieper-Donets Depression and in the NW part of Donets basin are considered to be promising for disposal of high-level radioactive waste (HLRW). Rock salt occurs there either as bedded salts or as salt pillows and salt diapirs. Preliminary studies have resulted in selection of several candidate sites that show promise for construction of a subsurface pilot lab. Ten salt domes and two sites in bedded salts have been proposed for further exploration. Based on microstructural studies it is possible to separate the body of a salt structure and to locate within its limits the rock salt structure and to locate within its limits the rock salt blocks of different genesis, i.e.: (a) blocks characteristic of initial undisturbed sedimentary structure; (b) flow zones; (c) sliding planes; (d) bodies of loose or uncompacted rock salt. Ultramicrochemical examination of inclusions in halite have shown that they are composed of more than 40 minerals. It is emphasized that to assess suitability of a structure for construction of subsurface lab, and also the potential construction depth intervals, account should be taken of the results of ultra microchemical and microstructural data

Unraveling the nature of electric field- and stress- induced structural transformations in soft PZT by a new powder poling technique.

Science.gov (United States)

Kalyani, Ajay Kumar; V, Lalitha K; James, Ajit R; Fitch, Andy; Ranjan, Rajeev

2015-02-25

A 'powder-poling' technique was developed to study electric field induced structural transformations in ferroelectrics exhibiting a morphotropic phase boundary (MPB). The technique was employed on soft PZT exhibiting a large longitudinal piezoelectric response (d(33) ∼ 650 pC N(-1)). It was found that electric poling brings about a considerable degree of irreversible tetragonal to monoclinic transformation. The same transformation was achieved after subjecting the specimen to mechanical stress, which suggests an equivalence of stress and electric field with regard to the structural mechanism in MPB compositions. The electric field induced structural transformation was also found to be accompanied by a decrease in the spatial coherence of polarization.

Thin- and thick-skinned salt tectonics in the Netherlands: a quantitative approach

NARCIS (Netherlands)

Veen, J.H. ten; Gessel, S.F. van; Dulk, M. den

2012-01-01

The Zechstein salt in the Dutch part of the North Sea Basin played a key role in the generation of successful petroleum plays. This is not only because of its sealing capacity, but also because the salt occurs in structures that provide lateral and vertical traps. The structural styles of areas with

An improved partially interleaved transformer structure for high-voltage high-frequency multiple-output applications

DEFF Research Database (Denmark)

Zhao, Bin; Ouyang, Ziwei; Andersen, Michael A. E.

2017-01-01

. The proposed structure features lower leakage inductance, smaller AC capacitance and lower rate of AC-DC resistance, which is suitable for high-frequency high-efficiency applications. A planar transformer with the proposed structure was built and tested in an LCLC resonant converter, where the input voltage...

Improved Design and Fabrication of Hydrated-Salt Pills

Science.gov (United States)

Shirron, Peter J.; DiPirro, Michael J.; Canavan, Edgar R.

2011-01-01

A high-performance design, and fabrication and growth processes to implement the design, have been devised for encapsulating a hydrated salt in a container that both protects the salt and provides thermal conductance between the salt and the environment surrounding the container. The unitary salt/container structure is known in the art as a salt pill. In the original application of the present design and processes, the salt is, more specifically, a hydrated paramagnetic salt, for use as a refrigerant in a very-low-temperature adiabatic demagnetization refrigerator (ADR). The design and process can also be applied, with modifications, to other hydrated salts. Hydrated paramagnetic salts have long been used in ADRs because they have the desired magnetic properties at low temperatures. They also have some properties, disadvantageous for ADRs, that dictate the kind of enclosures in which they must be housed: Being hydrated, they lose water if exposed to less than 100-percent relative humidity. Because any dehydration compromises their magnetic properties, salts used in ADRs must be sealed in hermetic containers. Because they have relatively poor thermal conductivities in the temperature range of interest (<0.1 K), integral thermal buses are needed as means of efficiently transferring heat to and from the salts during refrigeration cycles. A thermal bus is typically made from a high-thermal-conductivity met al (such as copper or gold), and the salt is configured to make intimate thermal contact with the metal. Commonly in current practice (and in the present design), the thermal bus includes a matrix of wires or rods, and the salt is grown onto this matrix. The density and spacing of the conductors depend on the heat fluxes that must be accommodated during operation.

Hydrothermal syntheses and anion-induced structural transformation of three Cadmium phosphonates

Science.gov (United States)

Hu, Han; Zhai, Fupeng; Liu, Xiaofeng; Ling, Yun; Chen, Zhenxia; Zhou, Yaming

2018-05-01

Three cadmium phosphonate coordinated polymers, namely as [Cd5(ptz)3(SO4)2(5H2O)]·6H2O (Cdptz-1), [Cd3(ptz)2(Cl)2(4H2O)]·2H2O (Cdptz-2) and [Cd4(ptz)2(SO4)(Cl)(OH)H2O]·H2O (Cdptz-3) have been hydrothermally synthesized using 4-(1,2,4-triazol-4-yl)phenylphosphonic acid (H2ptz) as ligand. Single crystal X-ray analyses revealed Cdptz-2 as layered structure and Cdptz-1,3 as pillar-layered structures with Cl- or SO42- as bridging anions. Due to the weak bonding between metal and anions, Cdptz-1 and 2 can reversibly convert into each other by simple immersing in the corresponding solution at room temperature. While the transformations between Cdptz-1,2 and Cdptz-3 can only happen under hydrothermal condition. The causes for the transformation involve the metal-ligand bond breaking/formation, replacement of anions and enhancement/decrement of the network dimensionality.

Polymeric salt bridges for conducting electric current in microfluidic devices

Science.gov (United States)

Shepodd, Timothy J [Livermore, CA; Tichenor, Mark S [San Diego, CA; Artau, Alexander [Humacao, PR

2009-11-17

A "cast-in-place" monolithic microporous polymer salt bridge for conducting electrical current in microfluidic devices, and methods for manufacture thereof is disclosed. Polymeric salt bridges are formed in place in capillaries or microchannels. Formulations are prepared with monomer, suitable cross-linkers, solvent, and a thermal or radiation responsive initiator. The formulation is placed in a desired location and then suitable radiation such as UV light is used to polymerize the salt bridge within a desired structural location. Embodiments are provided wherein the polymeric salt bridges have sufficient porosity to allow ionic migration without bulk flow of solvents therethrough. The salt bridges form barriers that seal against fluid pressures in excess of 5000 pounds per square inch. The salt bridges can be formulated for carriage of suitable amperage at a desired voltage, and thus microfluidic devices using such salt bridges can be specifically constructed to meet selected analytical requirements.

A DNA Structure-Based Bionic Wavelet Transform and Its Application to DNA Sequence Analysis

Directory of Open Access Journals (Sweden)

Fei Chen

2003-01-01

Full Text Available DNA sequence analysis is of great significance for increasing our understanding of genomic functions. An important task facing us is the exploration of hidden structural information stored in the DNA sequence. This paper introduces a DNA structure-based adaptive wavelet transform (WT – the bionic wavelet transform (BWT – for DNA sequence analysis. The symbolic DNA sequence can be separated into four channels of indicator sequences. An adaptive symbol-to-number mapping, determined from the structural feature of the DNA sequence, was introduced into WT. It can adjust the weight value of each channel to maximise the useful energy distribution of the whole BWT output. The performance of the proposed BWT was examined by analysing synthetic and real DNA sequences. Results show that BWT performs better than traditional WT in presenting greater energy distribution. This new BWT method should be useful for the detection of the latent structural features in future DNA sequence analysis.

Salt-assisted and salt-suppressed sol-gel transitions of methylcellulose in water.

Science.gov (United States)

Xu, Y; Wang, C; Tam, K C; Li, L

2004-02-03

The effects of various salts on the sol-gel transition of aqueous methylcellulose (MC) solutions have been studied systematically by means of a micro differential scanning calorimeter. It was found that the heating process was endothermic while the cooling process was exothermic for both MC solutions with and without salts. The addition of salts did not change the patterns of gelation and degelation of MC. However, the salts could shift the sol-gel transition and the gel-sol transition to lower or higher temperatures from a pure MC solution, depending on the salt type. These opposite effects were termed the salt-assisted and salt-suppressed sol-gel transitions. Either the salt-assisted transition or the salt-suppressed sol-gel transition was a function of salt concentration. In addition, each salt was found to have its own concentration limit for producing a stable aqueous solution of MC at a given concentration of MC, which was related to the anionic charge density of the salt. Cations were proved to have weaker effects than anions. The "salt-out strength", defined as the salt effect per mole of anion, was obtained for each anion studied. The thermodynamic mechanisms involved in the salt-assisted and salt-suppressed sol-gel transitions are discussed.

N-Lauroyl sarcosine sodium salt mediated formation of hydroxyapatite microspheres via a hydrothermal route

International Nuclear Information System (INIS)

Xiao Xiufeng; Zheng Xuan; Liu Rongfang; Lu Yihua; Wu Shanshan

2012-01-01

Dandelion-like hydroxyapatite (HA) microspheres were successfully prepared using Ca(NO 3 ) 2 ·4H 2 O and (NH 4 ) 3 PO 4 ·3H 2 O as raw materials and N-Lauroyl sarcosine sodium salt (Sar-Na) as template via a hydrothermal route. The chemical composition, structure, morphology and thermal properties of the samples were characterized by X-ray diffraction (XRD), Fourier transform infrared spectroscope (FTIR), Scanning electron microscope (SEM) and Thermal gravimetric analysis (TG), respectively. The results demonstrate that, Sar-Na has great impact on the morphology of HA. With increasing the amount of Sar-Na, the morphology of HA varies from nanograins to nanorods, finally grows into dandelion-like microstructure. The obtained dandelion-like HA microspheres about 6 μm in diameter are composed of radially oriented nanorods. Furthermore, the possible formation mechanism of morphology change is also discussed. - Highlights: ► N-Lauroyl sarcosine sodium salt is firstly used to control the morphology of hydroxyapatite. ► The mechanism of Sar-Na on the morphology of hydroxyapatite are discussed in this paper. ► The dandelion-like microsphere hydroxyapatite are obtained at suitable conditions.

Structural and electronic properties of TiX (X=N, As) in rock salt and zinc blende phase: A DFT study

Energy Technology Data Exchange (ETDEWEB)

Verma, U. P.; Nayak, V. [School of Studies in Phyics, jiwaji University, Gwalior-474011 (India)

2016-05-23

Quantum mechanical first principle calculations have been performed to study the electronic and structural properties of TiN and TiAs in zinc blende (ZB) and rock salt (RS) structures. The full-potential linearized augmented plane wave (FP-LAPW) method has been used within the framework of density functional theory (DFT). The exchange correlation functional has been solved employing generalized gradient approximation (GGA). Our predicted results for lattice constants are in good agreement with the earlier findings. The electronic band structures of TiX are metallic in both the phases.

Ab initio molecular dynamics simulation of structural transformation in zinc blende GaN under high pressure

International Nuclear Information System (INIS)

Xiao, H.Y.; Gao, Fei; Zu, X.T.; Weber, W.J.

2010-01-01

High-pressure induced zinc blende to rocksalt phase transition in GaN has been investigated by ab initio molecular dynamics method to characterize the transformation mechanism at the atomic level. It was shown that at 100 GPa GaN passes through tetragonal and monoclinic states before rocksalt structure is formed. The transformation mechanism is consistent with that for other zinc blende semiconductors obtained from the same method. Detailed structural analysis showed that there is no bond breaking involved in the phase transition.

Where Does Road Salt Go - a Static Salt Model

Science.gov (United States)

Yu, C. W.; Liu, F.; Moriarty, V. W.

2017-12-01

Each winter, more than 15 million tons of road salt is applied in the United States for the de-icing purpose. Considerable amount of chloride in road salt flows into streams/drainage systems with the snow melt runoff and spring storms, and eventually goes into ecologically sensitive low-lying areas in the watershed, such as ponds and lakes. In many watersheds in the northern part of US, the chloride level in the water body has increased significantly in the past decades, and continues an upward trend. The environmental and ecological impact of the elevated chloride level can no longer be ignored. However although there are many studies on the biological impact of elevated chloride levels, there are few investigations on how the spatially distributed road salt application affects various parts of the watershed. In this presentation, we propose a static road salt model as a first-order metric to address spacial distribution of salt loading. Derived from the Topological Wetness Index (TWI) in many hydrological models, this static salt model provides a spatial impact as- sessment of road salt applications. To demonstrate the effectiveness of the static model, National Elevation Dataset (NED) of ten-meter resolution of Lake George watershed in New York State is used to generate the TWI, which is used to compute a spatially dis- tributed "salt-loading coefficient" of the whole watershed. Spatially varying salt applica- tion rate is then aggregated, using the salt-loading coefficients as weights, to provide salt loading assessments of streams in the watershed. Time-aggregated data from five CTD (conductivity-temperature-depth) sensors in selected streams are used for calibration. The model outputs and the sensor data demonstrate a strong linear correlation, with the R value of 0.97. The investigation shows that the static modeling approach may provide an effective method for the understanding the input and transport of road salt to within watersheds.

Glycinebetaine synthesizing transgenic potato plants exhibit enhanced tolerance to salt and cold stresses

International Nuclear Information System (INIS)

Ahmad, R.; Hussain, J.

2014-01-01

Abiotic stresses are the most important contributors towards low productivity of major food crops. Various attempts have been made to enhance abiotic stress tolerance of crop plants by classical breeding and genetic transformation. Genetic transformation with glycinebetaine (GB) synthesizing enzymes' gene(s) in naturally non accumulating plants has resulted in enhanced tolerance against variety of abiotic stresses. Present study was aimed to evaluate the performance of GB synthesizing transgenic potato plants against salt and cold stresses. Transgenic potato plants were challenged against salt and cold stresses at whole plant level. Transgenic lines were characterized to determine the transgene copy number. Different parameters like integrity, chlorophyll contents, tuber yield and vegetative biomass were studied to monitor the stress tolerance of transgenic potato plants. The results were compared with Non-transgenic (NT) plants and statistically analyzed to evaluate significant differences. Multi-copy insertion of expression cassette was found in both transgenic lines. Upon salt stress, transgenic plants maintained better growth as compared to NT plants. The tuber yield of transgenic plants was significantly greater than NT plants in salt stress. Transgenic plants showed improved membrane integrity against cold stress by depicting appreciably reduced ion leakage as compared to NT plants. Moreover, transgenic plants showed significantly less chlorophyll bleaching than NT plants upon cold stress. In addition, NT plants accumulated significantly less biomass, and yielded fewer tubers as compared to transgenic plants after cold stress treatment. The study will be a committed step for field evaluation of transgenic plants with the aim of commercialization. (author)

Structural Modification of Fish Gelatin by the Addition of Gellan, κ-Carrageenan, and Salts Mimics the Critical Physicochemical Properties of Pork Gelatin.

Science.gov (United States)

Sow, Li Cheng; Kong, Karmaine; Yang, Hongshun

2018-05-01

Pork gelatin is not suitable for halal and kosher application; however, fish gelatin (FG) can be modified for use as a pork gelatin (PG) mimetic. Herein, low-acyl gellan (GE), κ-carrageenan (KC), and salts (CaCl 2 or KCl) were combined with a 180 Bloom tilapia FG. A formulation comprising 5.925% (w/v) FG + 0.025% (w/v) GE + 3mM CaCl 2 best matched the physicochemical properties of PG. The modification increased the FG gel strength from 115 ± 2 to 149 ± 2 g (matching the 148 ± 2 of PG), while the T m increased from 27.9 ± 1.0 to 32.4 ± 0.8 °C (matching the 33.1 ± 0.3 °C of PG). Nanoaggregates (diameter between 150 and 300 nm) could be an important structural factor affecting the physicochemical properties, as both PG and GE-modified FG showed a similar frequency distribution in this size group (57.4 ± 1.6% (PG) compared with 56.3 ± 2.2% (modified FG)). To further explore the differences between KC and GE in modifying of FG's structure, the FG-KC and FG-GE gels were compared. The zeta potential and Fourier transform infrared (FTIR) spectroscopy results for the FG-KC gel supported an associative interaction with complex formation, as indicated from the large aggregates and amorphous phase under atomic force microscopy (AFM). Contrastingly, a segregative FG-GE interaction took place in presence of CaCl 2 . These structures and interaction differences between FG-GE and FG-KC influenced the macro-properties of FG, possibly explaining the differences in the modification of the melting temperature of FG. A diagram representing the interaction-structure-physicochemical properties was proposed to explain the differences between the FG-GE and FG-KC gels. Certain people cannot consume any pork product or derivatives for religious reasons, thus it is essential to find a pork gelatin (PG) substitute for food product development. The commonly used polysaccharides, gellan and carrageenan, together with salt, can be added to fish gelatin (FG) to match the

Synthesis and textural evolution of alumina particles with mesoporous structures

Science.gov (United States)

Liu, Xun; Peng, Tianyou; Yao, Jinchun; Lv, Hongjin; Huang, Cheng

2010-06-01

Alumina particles with mesostructures were synthesized through a chemical precipitation method by using different inorganic aluminum salts followed by a heterogeneous azeotropic distillation and calcination process. The obtained mesoporous γ-alumina particles were systematically characterized by the X-ray diffraction, transmission electron microscopy and nitrogen adsorption-desorption measurement. Effects of the aluminum salt counter anion, pH value and the azeotropic distillation process on the structural or textural evolution of alumina particles were investigated. It is found that Cl - in the reaction solution can restrain the textural evolution of the resultant precipitates into two-dimensional crystallized pseudoboehmite lamellae during the heterogeneous azeotropic distillation, and then transformed into γ-Al 2O 3 particles with mesostructures after further calcination at 1173 K, whereas coexisting SO 42- can promote above morphology evolution and then transformed into γ-Al 2O 3 nanofibers after calcination at 1173 K. Moreover nearly all materials retain relatively high specific surface areas larger than 100 m 2 g -1 even after calcinations at 1173 K.

Graphite and carbonaceous materials in a molten salt nuclear reactor

International Nuclear Information System (INIS)

Rousseau, Ginette; Lecocq, Alfred; Hery, Michel.

1982-09-01

A project for a molten salt 1000 MWe reactor is studied by EDF-CEA teams. The design provides for a chromesco 3 vessel housing graphite structures in which the salt circulates. The salt (Th, U, Be and Li fluorides) is cooled by direct contact with lead. The graphites and carbonated materials, inert with respect to lead and the fuel salt, are being considered not only as moderators, but as reflectors and in the construction of the sections where the heat exchange takes place. On the basis of the problems raised in the operation of the reactor, a study programme on French experimental materials (Le Carbone Lorraine, SERS, SEP) has been defined. Hence, depending on the function or functions that the material is to ensure in the structure, the criteria of choice which follow will have to be examined: behaviour under irradiation, insertion of a fluid in the material, thermal properties required, mechanical properties required, utilization [fr

Bile salt receptor complex activates a pathogenic type III secretion system

Science.gov (United States)

Li, Peng; Rivera-Cancel, Giomar; Kinch, Lisa N; Salomon, Dor; Tomchick, Diana R; Grishin, Nick V; Orth, Kim

2016-01-01

Bile is an important component of the human gastrointestinal tract with an essential role in food absorption and antimicrobial activities. Enteric bacterial pathogens have developed strategies to sense bile as an environmental cue to regulate virulence genes during infection. We discovered that Vibrio parahaemolyticus VtrC, along with VtrA and VtrB, are required for activating the virulence type III secretion system 2 in response to bile salts. The VtrA/VtrC complex activates VtrB in the presence of bile salts. The crystal structure of the periplasmic domains of the VtrA/VtrC heterodimer reveals a β-barrel with a hydrophobic inner chamber. A co-crystal structure of VtrA/VtrC with bile salt, along with biophysical and mutational analysis, demonstrates that the hydrophobic chamber binds bile salts and activates the virulence network. As part of a family of conserved signaling receptors, VtrA/VtrC provides structural and functional insights into the evolutionarily conserved mechanism used by bacteria to sense their environment. DOI: http://dx.doi.org/10.7554/eLife.15718.001 PMID:27377244

Bile salt receptor complex activates a pathogenic type III secretion system

Energy Technology Data Exchange (ETDEWEB)

Li, Peng; Rivera-Cancel, Giomar; Kinch, Lisa N.; Salomon, Dor; Tomchick, Diana R.; Grishin, Nick V.; Orth, Kim

2016-07-05

Bile is an important component of the human gastrointestinal tract with an essential role in food absorption and antimicrobial activities. Enteric bacterial pathogens have developed strategies to sense bile as an environmental cue to regulate virulence genes during infection. We discovered thatVibrio parahaemolyticusVtrC, along with VtrA and VtrB, are required for activating the virulence type III secretion system 2 in response to bile salts. The VtrA/VtrC complex activates VtrB in the presence of bile salts. The crystal structure of the periplasmic domains of the VtrA/VtrC heterodimer reveals a β-barrel with a hydrophobic inner chamber. A co-crystal structure of VtrA/VtrC with bile salt, along with biophysical and mutational analysis, demonstrates that the hydrophobic chamber binds bile salts and activates the virulence network. As part of a family of conserved signaling receptors, VtrA/VtrC provides structural and functional insights into the evolutionarily conserved mechanism used by bacteria to sense their environment.

Effects of Hofmeister salt series on gluten network formation: Part I. Cation series.

Science.gov (United States)

Tuhumury, H C D; Small, D M; Day, L

2016-12-01

Different cationic salts were used to investigate the effects of the Hofmeister salt series on gluten network formation. The effects of cationic salts on wheat flour dough mixing properties, the rheological and the chemical properties of the gluten extracted from the dough with different respective salts, were investigated. The specific influence of different cationic salts on the gluten structure formation during dough mixing, compared to the sodium ion, were determined. The effects of different cations on dough and gluten of different flours mostly followed the Hofmeister series (NH4(+), K(+), Na(+), Mg(2+) and Ca(2+)). The impacts of cations on gluten structure and dough rheology at levels tested were relatively small. Therefore, the replacement of sodium from a technological standpoint is possible, particularly by monovalent cations such as NH4(+), or K(+). However the levels of replacement need to take into account sensory attributes of the cationic salts. Copyright © 2016 Elsevier Ltd. All rights reserved.

Ectopic over-expression of peroxisomal ascorbate peroxidase (SbpAPX) gene confers salt stress tolerance in transgenic peanut (Arachis hypogaea).

Science.gov (United States)

Singh, Natwar; Mishra, Avinash; Jha, Bhavanath

2014-08-15

Peroxisomal ascorbate peroxidase gene (SbpAPX) of an extreme halophyte Salicornia brachiata imparts abiotic stress endurance and plays a key role in the protection against oxidative stress. The cloned SbpAPX gene was transformed to local variety of peanut and about 100 transgenic plants were developed using optimized in vitro regeneration and Agrobacterium mediated genetic transformation method. The T0 transgenic plants were confirmed for the gene integration; grown under controlled condition in containment green house facility; seeds were harvested and T1 plants were raised. Transgenic plants (T1) were further confirmed by PCR using gene specific primers and histochemical GUS assay. About 40 transgenic plants (T1) were selected randomly and subjected for salt stress tolerance study. Transgenic plants remained green however non-transgenic plants showed bleaching and yellowish leaves under salt stress conditions. Under stress condition, transgenic plants continued normal growth and completed their life cycle. Transgenic peanut plants exhibited adequate tolerance under salt stress condition and thus could be explored for the cultivation in salt affected areas for the sustainable agriculture. Copyright © 2014 Elsevier B.V. All rights reserved.

Molten salt fueled reactors with a fast salt draining

International Nuclear Information System (INIS)

Ventre, Edmond; Blum, J.M.

1976-01-01

This invention relates to a molten salt nuclear reactor which comprises a new arrangement for shutting it down in complete safety. This nuclear reactor has a molten salt primary circuit comprising, in particular, the core of this reactor. It includes a leak tight vessel the capacity of which is appreciably greater than that of the molten salt volume of the circuit and placed so that the level of the molten salt, when all the molten salt of the circuit is contained in this vessel, is less than that of the base of the core. There are facilities for establishing and maintaining an inert gas pressure in the vessel above the molten salt, for releasing the compressed gas and for connecting the vessel to the primary circuit entering this vessel at a lower level than that of the molten salt and enabling molten salt to enter or leave the vessel according to the pressure of the inert gas. The particular advantage of this reactor is that it can be shut down safely since the draining of the primary circuit no longer results from a 'positive action' but from the suppression of an arrangement essential for the operation of the reactor consisting of the build-up of the said inert gas pressure in the said vessel [fr

Functionalized alkoxy arene diazonium salts from paracetamol.

Science.gov (United States)

Schmidt, Bernd; Berger, René; Hölter, Frank

2010-03-21

Arene diazonium tetrafluoroborates can be synthesized from aromatic acetamides via a sequence of deacetylation, diazotation and precipitation, induced by anion exchange. The reaction is conducted as a convenient one-flask transformation with consecutive addition of the appropriate reagents. Exchange of solvents or removal of byproducts prior to isolation of the product is not required. The arene diazonium salts are isolated from the reaction mixture by simple filtration. Two complementary protocols are presented, and the utility of the reaction is exemplified for a synthesis of the diarylheptanoid natural product de-O-methyl centrolobine.

Alternative nitrate reduction pathways in experimentally fertilized New England salt marshes

DEFF Research Database (Denmark)

Uldahl, Anne; Banta, Gary Thomas; Boegh, Eva

the ecosystem in the form of gaseous N2, while the last process transforms of NO3- to another biologically available form, NH4+, and thus merely recycles N. Salt marshes are important ecosystems for the cycling, retention and removal of biologically available N transported from land to the oceans. We used...... ongoing ecosystem level nutrient additions experiments in two New England salt marshes, Plum Island Sound (NO3- additions since 2003) and Great Sippewissett Marsh (fertilizer additions since the 1970's) to examine the relative importance of these NO3- reduction pathways in salt marshes. Sediments from...... several experimental (and unmanipulated) sites were collected during the late summer/fall of 2009 and summer 2010 to measure the potential rates of NO3- reduction in sediment slurries enriched with NO3- and 15NO3- added as a tracer. The resulting 15N-labeled products (30N2, 29N2 and 15NH4+) were analyzed...

Pharmaceutical cocrystals, salts and polymorphs: Advanced characterization techniques.

Science.gov (United States)

Pindelska, Edyta; Sokal, Agnieszka; Kolodziejski, Waclaw

2017-08-01

The main goal of a novel drug development is to obtain it with optimal physiochemical, pharmaceutical and biological properties. Pharmaceutical companies and scientists modify active pharmaceutical ingredients (APIs), which often are cocrystals, salts or carefully selected polymorphs, to improve the properties of a parent drug. To find the best form of a drug, various advanced characterization methods should be used. In this review, we have described such analytical methods, dedicated to solid drug forms. Thus, diffraction, spectroscopic, thermal and also pharmaceutical characterization methods are discussed. They all are necessary to study a solid API in its intrinsic complexity from bulk down to the molecular level, gain information on its structure, properties, purity and possible transformations, and make the characterization efficient, comprehensive and complete. Furthermore, these methods can be used to monitor and investigate physical processes, involved in the drug development, in situ and in real time. The main aim of this paper is to gather information on the current advancements in the analytical methods and highlight their pharmaceutical relevance. Copyright © 2017 Elsevier B.V. All rights reserved.

Counterion influence on chemical shifts in strychnine salts

Energy Technology Data Exchange (ETDEWEB)

Metaxas, Athena E.; Cort, John R.

2013-05-01

The highly toxic plant alkaloid strychnine is often isolated in the form of the anion salt of its protonated tertiary amine. Here we characterize the relative influence of different counterions on 1H and 13C chemical shifts in several strychnine salts in D2O, methanol-d4 (CD3OD) and chloroform-d (CDCl3) solvents. In organic solvents, but not in water, substantial variation in chemical shifts of protons near the tertiary amine was observed among different salts. These secondary shifts reveal differences in the way each anion influences electronic structure within the protonated amine. The distributions of secondary shifts allow salts to be easily distinguished from each other as well as from the free base form. The observed effects are much greater in organic solvents than in water. Slight concentration-dependence in chemical shifts of some protons near the amine was observed for two salts in CDCl3, but this effect is small compared to the influence of the counterion. Distinct chemical shifts in different salt forms of the same compound may be useful as chemical forensic signatures for source attribution and sample matching of alkaloids such as strychnine and possibly other organic acid and base salts.

Locating and classification of structure-borne sound occurrence using wavelet transformation

International Nuclear Information System (INIS)

Winterstein, Martin; Thurnreiter, Martina

2011-01-01

For the surveillance of nuclear facilities with respect to detached or loose parts within the pressure boundary structure-borne sound detector systems are used. The impact of loose parts on the wall causes energy transfer to the wall that is measured a so called singular sound event. The run-time differences of sound signals allow a rough locating of the loose part. The authors performed a finite element based simulation of structure-borne sound measurements using real geometries. New knowledge on sound wave propagation, signal analysis and processing, neuronal networks or hidden Markov models were considered. Using the wavelet transformation it is possible to improve the localization of structure-borne sound events.

Molten salt oxidation of organic hazardous waste with high salt content.

Science.gov (United States)

Lin, Chengqian; Chi, Yong; Jin, Yuqi; Jiang, Xuguang; Buekens, Alfons; Zhang, Qi; Chen, Jian

2018-02-01

Organic hazardous waste often contains some salt, owing to the widespread use of alkali salts during industrial manufacturing processes. These salts cause complications during the treatment of this type of waste. Molten salt oxidation is a flameless, robust thermal process, with inherent capability of destroying the organic constituents of wastes, while retaining the inorganic ingredients in the molten salt. In the present study, molten salt oxidation is employed for treating a typical organic hazardous waste with a high content of alkali salts. The hazardous waste derives from the production of thiotriazinone. Molten salt oxidation experiments have been conducted using a lab-scale molten salt oxidation reactor, and the emissions of CO, NO, SO 2 , HCl and dioxins are studied. Impacts are investigated from the composition of the molten salts, the types of feeding tube, the temperature of molten carbonates and the air factor. Results show that the waste can be oxidised effectively in a molten salt bath. Temperature of molten carbonates plays the most important role. With the temperature rising from 600 °C to 750 °C, the oxidation efficiency increases from 91.1% to 98.3%. Compared with the temperature, air factor has but a minor effect, as well as the composition of the molten salts and the type of feeding tube. The molten carbonates retain chlorine with an efficiency higher than 99.9% and the emissions of dioxins are below 8 pg TEQ g -1 sample. The present study shows that molten salt oxidation is a promising alternative for the disposal of organic hazardous wastes containing a high salt content.

Examining the Factor Structure of the MLQ Transactional and Transformational Leadership Dimensions in Nursing Context.

Science.gov (United States)

Boamah, Sheila A; Tremblay, Paul

2018-05-01

The Multifactor Leadership Questionnaire (MLQ) is the most widely used instrument for assessing dimensions of leadership style; yet, most studies have failed to reproduce the original MLQ factor structure. The current study evaluates the dimensionality and nomological validity of Bass's transactional and transformational leadership model using the MLQ in a sample of registered nurses working in acute care hospitals in Canada. A combination of exploratory and confirmatory factor analyses were used to evaluate the hypothetical factor structure of the MLQ consisting of five transformational factors, and three transactional factors. Results suggest that the eight-factor solution displayed best fit indices; however, two transactional factors should be extracted due to high interscale correlations and lack of differential relationships with the two leadership variables. The findings support a scale refinement and the need for new theory concerning the five transformational leadership and contingent reward dimensions of the MLQ.

Candidate molten salt investigation for an accelerator driven subcritical core

International Nuclear Information System (INIS)

Sooby, E.; Baty, A.; Beneš, O.; McIntyre, P.; Pogue, N.; Salanne, M.; Sattarov, A.

2013-01-01

Highlights: • Developing accelerator driven subcritical fission to destroy transuranics in SNF. • The core is a vessel containing a molten mixture of NaCl and transuranic chlorides. • Molecular dynamics used to calculate the thermophysical properties of the salt. • Density and molecular structure for actinide salts reported here. • The neutronics of ADS fission in molten salt are presented. -- Abstract: We report a design for accelerator-driven subcritical fission in a molten salt core (ADSMS) that utilizes a fuel salt composed of NaCl and transuranic (TRU) chlorides. The ADSMS core is designed for fast neutronics (28% of neutrons >1 MeV) to optimize TRU destruction. The choice of a NaCl-based salt offers benefits for corrosion, operating temperature, and actinide solubility as compared with LiF-based fuel salts. A molecular dynamics (MD) code has been used to estimate properties of the molten salt system which are important for ADSMS design but have never been measured experimentally. Results from the MD studies are reported. Experimental measurements of fuel salt properties and studies of corrosion and radiation damage on candidate metals for the core vessel are anticipated

Candidate molten salt investigation for an accelerator driven subcritical core

Energy Technology Data Exchange (ETDEWEB)

Sooby, E., E-mail: soobyes@tamu.edu [Texas A and M University, Accelerator Research Laboratory, 3380 University Dr. East, College Station, TX 77845 (United States); Baty, A. [Texas A and M University, Accelerator Research Laboratory, 3380 University Dr. East, College Station, TX 77845 (United States); Beneš, O. [European Commission, DG Joint Research Centre, Institute for Transuranium Elements, P.O. Box 2340, 76125 Karlsruhe (Germany); McIntyre, P.; Pogue, N. [Texas A and M University, Accelerator Research Laboratory, 3380 University Dr. East, College Station, TX 77845 (United States); Salanne, M. [Université Pierre et Marie Curie, CNRS, Laboratoire PECSA, F-75005 Paris (France); Sattarov, A. [Texas A and M University, Accelerator Research Laboratory, 3380 University Dr. East, College Station, TX 77845 (United States)

2013-09-15

Highlights: • Developing accelerator driven subcritical fission to destroy transuranics in SNF. • The core is a vessel containing a molten mixture of NaCl and transuranic chlorides. • Molecular dynamics used to calculate the thermophysical properties of the salt. • Density and molecular structure for actinide salts reported here. • The neutronics of ADS fission in molten salt are presented. -- Abstract: We report a design for accelerator-driven subcritical fission in a molten salt core (ADSMS) that utilizes a fuel salt composed of NaCl and transuranic (TRU) chlorides. The ADSMS core is designed for fast neutronics (28% of neutrons >1 MeV) to optimize TRU destruction. The choice of a NaCl-based salt offers benefits for corrosion, operating temperature, and actinide solubility as compared with LiF-based fuel salts. A molecular dynamics (MD) code has been used to estimate properties of the molten salt system which are important for ADSMS design but have never been measured experimentally. Results from the MD studies are reported. Experimental measurements of fuel salt properties and studies of corrosion and radiation damage on candidate metals for the core vessel are anticipated.

Permanent Disposal of Nuclear Waste in Salt

Science.gov (United States)

Hansen, F. D.

2016-12-01

Salt formations hold promise for eternal removal of nuclear waste from our biosphere. Germany and the United States have ample salt formations for this purpose, ranging from flat-bedded formations to geologically mature dome structures. Both nations are revisiting nuclear waste disposal options, accompanied by extensive collaboration on applied salt repository research, design, and operation. Salt formations provide isolation while geotechnical barriers reestablish impermeability after waste is placed in the geology. Between excavation and closure, physical, mechanical, thermal, chemical, and hydrological processes ensue. Salt response over a range of stress and temperature has been characterized for decades. Research practices employ refined test techniques and controls, which improve parameter assessment for features of the constitutive models. Extraordinary computational capabilities require exacting understanding of laboratory measurements and objective interpretation of modeling results. A repository for heat-generative nuclear waste provides an engineering challenge beyond common experience. Long-term evolution of the underground setting is precluded from direct observation or measurement. Therefore, analogues and modeling predictions are necessary to establish enduring safety functions. A strong case for granular salt reconsolidation and a focused research agenda support salt repository concepts that include safety-by-design. Sandia National Laboratories is a multi-program laboratory managed and operated by Sandia Corporation, a wholly owned subsidiary of Lockheed Martin Corporation, for the U.S. Department of Energy's National Nuclear Security Administration under contract DE-AC04-94AL85000. Author: F. D. Hansen, Sandia National Laboratories

The structural evolution and diffusion during the chemical transformation from cobalt to cobalt phosphide nanoparticles

KAUST Repository

Ha, Don-Hyung; Moreau, Liane M.; Bealing, Clive R.; Zhang, Haitao; Hennig, Richard G.; Robinson, Richard D.

2011-01-01

We report the structural evolution and the diffusion processes which occur during the phase transformation of nanoparticles (NPs), ε-Co to Co 2P to CoP, from a reaction with tri-n-octylphosphine (TOP). Extended X-ray absorption fine structure (EXAFS

The Bravyi-Kitaev transformation for quantum computation of electronic structure

Science.gov (United States)

Seeley, Jacob T.; Richard, Martin J.; Love, Peter J.

2012-12-01

Quantum simulation is an important application of future quantum computers with applications in quantum chemistry, condensed matter, and beyond. Quantum simulation of fermionic systems presents a specific challenge. The Jordan-Wigner transformation allows for representation of a fermionic operator by O(n) qubit operations. Here, we develop an alternative method of simulating fermions with qubits, first proposed by Bravyi and Kitaev [Ann. Phys. 298, 210 (2002), 10.1006/aphy.2002.6254; e-print arXiv:quant-ph/0003137v2], that reduces the simulation cost to O(log n) qubit operations for one fermionic operation. We apply this new Bravyi-Kitaev transformation to the task of simulating quantum chemical Hamiltonians, and give a detailed example for the simplest possible case of molecular hydrogen in a minimal basis. We show that the quantum circuit for simulating a single Trotter time step of the Bravyi-Kitaev derived Hamiltonian for H2 requires fewer gate applications than the equivalent circuit derived from the Jordan-Wigner transformation. Since the scaling of the Bravyi-Kitaev method is asymptotically better than the Jordan-Wigner method, this result for molecular hydrogen in a minimal basis demonstrates the superior efficiency of the Bravyi-Kitaev method for all quantum computations of electronic structure.

Hyperfine structure of ScI by infrared Fourier transform spectroscopy

International Nuclear Information System (INIS)

Aboussaid, A.; Carleer, M.; Hurtmans, D.; Biemont, E.; Godefroid, M.R.

1996-01-01

The spectrum of scandium was recorded in the infrared region using a high resolution Fourier transform spectrometer and a hollow-cathode discharge. Hyperfine structures of the lines connecting the 3d 2 4s and 3d4s4p level systems of Sc 45 I were observed between 4000 and 5000 cm -1 . The structures were not completely resolved but the individual line contributions to the complex profiles were simulated using the 3d 2 4s 4 F J hyperfine structure constants previously measured with a high precision by laser techniques. We investigate the possibility of extracting the hyperfine constants of the 3d4s4p levels from a least-squares fit of the line profiles, assuming a Doppler lineshape and theoretical relative intensities. New results are presented for 12 levels. (orig.)

A fresh method of DNA transformation to the seeds irradiated by Co ...

African Journals Online (AJOL)

Jane

2011-06-29

Jun 29, 2011 ... To find out a simpler method that can directly transfer the aim gene into plant ... Key words: DNA transformation, irradiated seeds, purple medic, salt screening. ..... characterization of a maize mitochondrial plasmid-like DNA.

Structure of human milk bile salt activated lipase

International Nuclear Information System (INIS)

Baba, T.; Downs, D.; Jackson, K.W.; Tang, J.; Wang, Chi-Sun

1991-01-01

The structure and some functional sites of human milk bile salt activated lipase (BAL) were studied by cDNA cloning and chemical analysis of the enzyme. Eighteen cDNA clones of human BAL were identified from lactating human breast cDNA libraries in λgt11 and λgt10 with antibody and synthetic oligonucleotides as probes. The sequence of four clones was sufficient to construct a 3018-bp BAL cDNA structure. This sequence codes for an open reading frame of 742 amino acid residues. There is a putative signal sequence of 20 residues which is followed by the amino-terminal sequence of BAL, and the mature BAL contains 722 amino acid residues. The cDNA sequence also contains a 678-base 5'-untranslated sequence, a 97-base 3'-untranslated region, and a 14-base poly(A) tail. The sequence of a 1.8-kbp insert of clone G10-4A differs from that of the other cDNA in that it contains a deletion of 198 bases (1966-2163) corresponding to 66 amino acid residues. By use of BAL cDAN as probe, it was found that the major molecular species of BAL mRNA in human mammary gland HBL-100 cells had a size of 2.9 kb and two minor species had sizes of 3.8 and 5.1 kb by Northern blot analyses. These chemical studies established that the active site of human milk BAL is located at serine-194, the N-glycosylation site is present at asparagine-187, the O-glycosylation region is in the 16 repeating units near the C-terminus, and the heparin binding domain is in the N-terminal region. The authors have also determined the location of disulfide bridges as Cys64-Cys80 and Cys246-Cys257. The cyanogen bromide cleavage and the partial sequencing of CNBr peptides also confirmed the location of methionines in the polypeptide chain as well as the deduced cDNA sequence of BAL

Study of constraints in using household NaCl salt for retrospective dosimetry

Science.gov (United States)

Elashmawy, M.

2018-05-01

Thermoluminescence (TL) characteristics of 5 different household NaCl salts and one analytical salt were determined to investigate the possible factors that affect the reliability of using household salt for retrospective dosimetry. Salts' TL sensitivities were found to be particle-size dependent and approached saturation at the largest size, whereas for salts that have the same particle size, the TL sensitivity depended on their origin. TL dependence on the particle size interprets significant variations in TL response reported in the literature for the same salt patch. The first TL readout indicated that all salts have similar glow curves with one distinctive peak. Typical second TL readout at two different doses showed a dramatic decrease in TL sensitivity associated with a significant change in the glow curve structure possessing two prominent peaks. Glow curve deconvolution (GCD) of the first TL readout for all salts yielded 6 individual glow peaks of first-order kinetics, whereas in GCD of second TL readouts, 5 individual glow peaks of second-order kinetics were obtained. Similarities in the glow curve structures of the first and second TL readouts suggest that additives such as KIO3 and MgCO3 have no effect on the TL process. Fading effect was evaluated for the salt of highest TL sensitivity, and it was found that the integral TL intensity decreased gradually and lost 40% of its initial value over 2 weeks, after which it remained constant. Results conclude that a household salt cannot be used for retrospective dosimetry without considering certain constraints such as the salt's origin and particle size. Furthermore, preparedness for radiological accidents and accurate dose reconstructions require that most of the commonly distributed household salt brands should be calibrated in advance and stored in a repository to be recalled in case of accidents.

SSR-based association mapping of salt tolerance in cotton (Gossypium hirsutum L.).

Science.gov (United States)

Zhao, Y L; Wang, H M; Shao, B X; Chen, W; Guo, Z J; Gong, H Y; Sang, X H; Wang, J J; Ye, W W

2016-05-25

The identification of simple sequence repeat (SSR) markers associated with salt tolerance in cotton contributes to molecular assisted selection (MAS), which can improve the efficiency of traditional breeding. In this study, 134 samples of upland cotton cultivars were selected. The seedling emergence rates were tested under 0.3% NaCl stress. A total of 74 SSR markers were used to scan the genomes of these samples. To identify SSR markers associated with salt tolerance, an association analysis was performed between salt tolerance and SSR markers using TASSEL 2.1, based on the analysis of genetic structure using Structure 2.3.4. The results showed that the seedling emergence rates of 134 cultivars were significantly different, and 27 salt-sensitive and 10 salt-tolerant cultivars were identified. A total of 148 loci were found in 74 SSR markers involving 246 allelic variations, which ranged from 2 to 7 with an average of 3.32 per SSR marker. The gene diversity ranged from 0.0295 to 0.4959, with the average being 0.2897. The polymorphic information content ranged from0.0290 to 0.3729, with the average being 0.2381. This natural population was classified into two subgroups by Structure 2.3.4, containing 89 and 45 samples, respectively. Finally, eight SSR sites associated with salt tolerance ware found through an association analysis, with the rate of explanation ranging from 2.91 to 7.82% and an average of 4.32%. These results provide reference data for the use MAS for salt tolerance in cotton.

Integrated geophysical study of the Triassic salt bodies' geometry and evolution in central Tunisia

Science.gov (United States)

Azaiez, Hajer; Amri, Dorra Tanfous; Gabtni, Hakim; Bedir, Mourad; Soussi, Mohamed

2008-01-01

A comprehensive study, integrating gravity, magnetic and seismic reflection data, has been used to resolve the complex Triassic salt body geometry and evolution in central Tunisia. Regional seismic lines across the study area show a detachment level in the Upper Triassic evaporites, associated with chaotic seismic facies below the Souinia, Majoura, and Mezzouna structures. The Jurassic and Lower Cretaceous seismic horizons display pinching-outs and onlapping around these structures. A stack-velocity section confirms the existence of a high-velocity body beneath the Souinia Mountain. Regional gravity and magnetic profiles in this area were elaborated from ETAP (the Tunisian Firm of Petroleum Activities) measure stations. These profiles were plotted following the same layout from the west (Souinia) to the east (Mezzouna), across the Majoura and Kharrouba mountains. They highlight associated gravity and magnetic negative anomalies. These gravity and magnetic data coupled to the reflection seismic data demonstrate that, in the Souinia, Majoura, and El Hafey zones, the Triassic salt reaches a salt pillow and a salt-dome stage, without piercing the cover. These stages are expressed by moderately low gravity anomalies. On the other hand, in the Mezzouna area (part of the North-South Axis), the Triassic salt had pierced its cover during the Upper Cretaceous and the Tertiary, reaching a more advanced stage as a salt diapir and salt wall. These stages express important low gravity and magnetic anomalies. These results confirm the model of Tanfous et al. (2005) of halokinetic movements by fault intrusions inducing, from the west to the east, structures at different stages of salt pillow, salt dome, and salt diapir.

Salt-induced aggregation of stiff polyelectrolytes

International Nuclear Information System (INIS)

Fazli, Hossein; Mohammadinejad, Sarah; Golestanian, Ramin

2009-01-01

Molecular dynamics simulation techniques are used to study the process of aggregation of highly charged stiff polyelectrolytes due to the presence of multivalent salt. The dominant kinetic mode of aggregation is found to be the case of one end of one polyelectrolyte meeting others at right angles, and the kinetic pathway to bundle formation is found to be similar to that of flocculation dynamics of colloids as described by Smoluchowski. The aggregation process is found to favor the formation of finite bundles of 10-11 filaments at long times. Comparing the distribution of the cluster sizes with the Smoluchowski formula suggests that the energy barrier for the aggregation process is negligible. Also, the formation of long-lived metastable structures with similarities to the raft-like structures of actin filaments is observed within a range of salt concentration.

Properties of organic salt superconductors

International Nuclear Information System (INIS)

Whangbo, M.H.; Jung, D.; Evain, M.; Williams, J.M.; Beno, M.A.; Schultz, A.J.

1989-01-01

Structural and electronic properties of the β- and κ-phase superconducting salts of organic donor molecules are compared. Importance of donor... donor and donor...anion interactions involving the C-H bonds in setting the lattice softness, the electron-phonon coupling constant, and the superconducting transitions temperature are discussed

Heat capacity anomalies associated with structural transformations in. beta. -W and perovskite compounds

Energy Technology Data Exchange (ETDEWEB)

Viswanathan, R [Brookhaven National Lab., Upton, NY; Ho, J C

1977-01-01

The similarity of the heat capacity anomalies, often observed with structural transformations driven by soft phonons, in both ..beta..-W and perovskite compounds is discussed referring to our recent work on V/sub 3/Si and RbCaF/sub 3/.

Geology of the north end of the Salt Valley Anticline, Grand County, Utah

International Nuclear Information System (INIS)

Gard, L.M. Jr.

1976-01-01

The geology and hydrology of a portion of the Salt Valley anticline lying north of Moab, Utah, that is being studied as a potential site for underground storage of nuclear waste in salt are discussed. Selection of this area was based on recommendations made in an earlier appraisal of the potential of Paradox basin salt deposits for such use. Salt Valley anticline, a northwest-trending diapiric structure, consists of Mesozoic sedimentary rocks arched over a thick core of salt of the Paradox Member of the Middle Pennsylvanian Hermosa Formation. Salt began to migrate to form and/or develop this structure shortly after it was deposited, probably in response to faulting. This migration caused upwelling of the salt creating a linear positive area. This positive area, in turn, caused increased deposition of sediments in adjacent areas which further enhanced salt migration. Not until late Jurassic time had flowage of the salt slowed sufficiently to allow sediments of the Morrison and younger formations to be deposited across the salt welt. A thick cap of insoluble residue was formed on top of the salt diapir as a result of salt dissolution through time. The crest of the anticline is breached; it collapsed in two stages during the Tertiary Period. The first stage was graben collapse during the early Tertiary; the second stage occurred after Miocene regional uplift had caused downcutting streams to breach the salt core resulting in further collapse. The axis of the anticline is a narrow generally flat-floored valley containing a few hills composed of downdropped Mesozoic rocks foundered in thecaprock. The caprock, which underlies thin alluvium in the valley, is composed of contorted gypsum, shale, sandstone, and limestone--the insoluble residue of the Paradox salt

Impact of solid second phases on deformation mechanisms of naturally deformed salt rocks (Kuh-e-Namak, Dashti, Iran) and rheological stratification of the Hormuz Salt Formation

Science.gov (United States)

Závada, P.; Desbois, G.; Urai, J. L.; Schulmann, K.; Rahmati, M.; Lexa, O.; Wollenberg, U.

2015-05-01

Viscosity contrasts displayed in flow structures of a mountain namakier (Kuh-e-Namak - Dashti), between 'weak' second phase bearing rock salt and 'strong' pure rock salt types are studied for deformation mechanisms using detailed quantitative microstructural study. While the solid inclusions rich ("dirty") rock salts contain disaggregated siltstone and dolomite interlayers, "clean" salts reveal microscopic hematite and remnants of abundant fluid inclusions in non-recrystallized cores of porphyroclasts. Although the flow in both, the recrystallized "dirty" and "clean" salt types is accommodated by combined mechanisms of pressure-solution creep (PS), grain boundary sliding (GBS), transgranular microcracking and dislocation creep accommodated grain boundary migration (GBM), their viscosity contrasts observed in the field outcrops are explained by: 1) enhanced ductility of "dirty" salts due to increased diffusion rates along the solid inclusion-halite contacts than along halite-halite contacts, and 2) slow rates of intergranular diffusion due to dissolved iron and inhibited dislocation creep due to hematite inclusions for "clean" salt types Rheological contrasts inferred by microstructural analysis between both salt rock classes apply in general for the "dirty" salt forming Lower Hormuz and the "clean" salt forming the Upper Hormuz of the Hormuz Formation and imply strain rate gradients or decoupling along horizons of mobilized salt types of different composition and microstructure.

A basic study on fluoride-based molten salt electrolysis technology

Energy Technology Data Exchange (ETDEWEB)

Hwang, Il Soon [Seoul National University, Seoul (Korea); Kim, Kwang Bum [Yonsei University, Seoul (Korea); Park, Byung Gi [Seoul National University, Seoul (Korea)

2001-04-01

The objective of this project is to study on the physicochemical properties of fluoride molten salt, to develop numerical model for simulation of molten salt electrolysis, and to establish experimental technique of fluoride molten salt. Physicochemical data of fluoride molten salt are investigated and summarized. The numerical model, designated as REFIN is developed with diffusion-layer theory and electrochemical reaction kinetics. REFIN is benchmarked with published experimental data. REFIN has a capability to simulate multicomponent electrochemical system at transient conditions. Experimental device is developed to measure electrochemical properties of structural material for fluoride molten salt. Ni electrode is measured with cyclic voltammogram in the conditions of 600 .deg. C LiF-BeF{sub 2} and 700 .deg. C LiF-BeF{sub 2}. 74 refs., 23 figs., 57 tabs. (Author)

Charge ordered insulating phases of DODHT salts with octahedral anions and a new radical salt, {beta}''-(DODHT){sub 2}TaF{sub 6}

Energy Technology Data Exchange (ETDEWEB)

Nishikawa, H; Oshio, H; Yasuzuka, S [Graduate School of Pure and Applied Sciences, University of Tsukuba, Tsukuba, Ibaraki 305-8571 (Japan); Higa, M; Kondo, R; Kagoshima, S [Department of Basic Science, University of Tokyo, Tokyo 153-8902 (Japan); Nakao, A; Sawa, H [Photon Factory, Institute of Material Structure Science, High Energy Accelerator Research Organization, Tsukuba, Ibaraki 305-0801 (Japan); Murata, K [Graduate School of Science, Osaka City University, Osaka 558-8585 (Japan)], E-mail: nishikaw@chem.tsukuba.ac.jp

2008-10-15

Physical properties of isostructural {beta}''-(DODHT){sub 2}X [DODHT = (l,4-dioxane-2,3-diyldithio)dihydrotetrathiafulvalene; X = PF{sub 6}, AsF{sub 6}, and SbF{sub 6}] at ambient pressure have been compared. The insulating phase of {beta}''-(DODHT){sub 2}PF{sub 6} salt has already been revealed to be a charge ordering (CO) state by X-ray diffraction study and magnetic behavior. CO in this salt was also confirmed by the observation of satellite reflections in oscillation photograph using synchrotron radiation. Transport property of {beta}''-(DODHT){sub 2}SbF{sub 6} salt was reinvestigated up to the pressure of 3.7 GPa applied by a cubic anvil apparatus. Although the SbF{sub 6} salt turned to be metallic above 2.0 GPa, no superconductivity was observed. In order to examine the anion size dependence of DODHT salts with octahedral anions, we prepared a new DODHT salt, {beta}''-(DODHT){sub 2}TaF{sub 6}, which has the larger counter anion compared with the previous salts. Crystal structure of this salt was isostructural to the other DODHT salts. The electrical and magnetic properties of this salt were similar to those of {beta}''-(DODHT){sub 2}SbF{sub 6} salt.

Phase and structural transformations in annealed copper coatings in relation to oxide whisker growth

Energy Technology Data Exchange (ETDEWEB)

Dorogov, M.V.; Priezzheva, A.N. [Togliatti State University, Belorusskaya 14, 445667 Togliatti (Russian Federation); Vlassov, S., E-mail: vlassovs@ut.ee [Institute of Solid State Physics, University of Latvia, Kengaraga 8, LV-1063 Riga (Latvia); Kink, I.; Shulga, E. [Institute of Physics, University of Tartu, Ravila 14c, 50411 Tartu (Estonia); Dorogin, L.M. [Togliatti State University, Belorusskaya 14, 445667 Togliatti (Russian Federation); Institute of Physics, University of Tartu, Ravila 14c, 50411 Tartu (Estonia); ITMO University, Kronverkskiy 49, 197101 Saint Petersburg (Russian Federation); Lõhmus, R. [Institute of Physics, University of Tartu, Ravila 14c, 50411 Tartu (Estonia); Tyurkov, M.N.; Vikarchuk, A.A. [Togliatti State University, Belorusskaya 14, 445667 Togliatti (Russian Federation); Romanov, A.E. [Togliatti State University, Belorusskaya 14, 445667 Togliatti (Russian Federation); Institute of Physics, University of Tartu, Ravila 14c, 50411 Tartu (Estonia); ITMO University, Kronverkskiy 49, 197101 Saint Petersburg (Russian Federation); Ioffe Physical Technical Institute, RAS, Polytechnicheskaya 26, 194021 Saint Petersburg (Russian Federation)

2015-08-15

Highlights: • Coatings prepared by Cu microparticle electrodeposition. • Structural and phase transformation in Cu coatings annealed at 400 °C. • Annealing is accompanied by intensive growth of CuO whiskers. • Layered oxide phases (Cu{sub 2}O and CuO) in the coating are characterized. • Formation of volumetric defects in the coating is demonstrated. - Abstract: We describe structural and phase transformation in copper coatings made of microparticles during heating and annealing in air in the temperature range up to 400 °C. Such thermal treatment is accompanied by intensive CuO nanowhisker growth on the coating surface and the formation of the layered oxide phases (Cu{sub 2}O and CuO) in the coating interior. X-ray diffraction and focused ion beam (FIB) are employed to characterize the multilayer structure of annealed copper coatings. Formation of volumetric defects such as voids and cracks in the coating is demonstrated.

LIFE Materails: Molten-Salt Fuels Volume 8

Energy Technology Data Exchange (ETDEWEB)

Moir, R; Brown, N; Caro, A; Farmer, J; Halsey, W; Kaufman, L; Kramer, K; Latkowski, J; Powers, J; Shaw, H; Turchi, P

2008-12-11

The goals of the Laser Inertial Fusion Fission Energy (LIFE) is to use fusion neutrons to fission materials with no enrichment and minimum processing and have greatly reduced wastes that are not of interest to making weapons. Fusion yields expected to be achieved in NIF a few times per day are called for with a high reliable shot rate of about 15 per second. We have found that the version of LIFE using TRISO fuel discussed in other volumes of this series can be modified by replacing the molten-flibe-cooled TRISO fuel zone with a molten salt in which the same actinides present in the TRISO particles are dissolved in the molten salt. Molten salts have the advantage that they are not subject to radiation damage, and hence overcome the radiation damage effects that may limit the lifetime of solid fuels such as TRISO-containing pebbles. This molten salt is pumped through the LIFE blanket, out to a heat exchanger and back into the blanket. To mitigate corrosion, steel structures in contact with the molten salt would be plated with tungsten or nickel. The salt will be processed during operation to remove certain fission products (volatile and noble and semi-noble fission products), impurities and corrosion products. In this way neutron absorbers (fission products) are removed and neutronics performance of the molten salt is somewhat better than that of the TRISO fuel case owing to the reduced parasitic absorption. In addition, the production of Pu and rare-earth elements (REE) causes these elements to build up in the salt, and leads to a requirement for a process to remove the REE during operation to insure that the solubility of a mixed (Pu,REE)F3 solid solution is not exceeded anywhere in the molten salt system. Removal of the REE will further enhance the neutronics performance. With molten salt fuels, the plant would need to be safeguarded because materials of interest for weapons are produced and could potentially be removed.

LIFE Materails: Molten-Salt Fuels Volume 8

International Nuclear Information System (INIS)

Moir, R.; Brown, N.; Caro, A.; Farmer, J.; Halsey, W.; Kaufman, L.; Kramer, K.; Latkowski, J.; Powers, J.; Shaw, H.; Turchi, P.

2008-01-01

The goals of the Laser Inertial Fusion Fission Energy (LIFE) is to use fusion neutrons to fission materials with no enrichment and minimum processing and have greatly reduced wastes that are not of interest to making weapons. Fusion yields expected to be achieved in NIF a few times per day are called for with a high reliable shot rate of about 15 per second. We have found that the version of LIFE using TRISO fuel discussed in other volumes of this series can be modified by replacing the molten-flibe-cooled TRISO fuel zone with a molten salt in which the same actinides present in the TRISO particles are dissolved in the molten salt. Molten salts have the advantage that they are not subject to radiation damage, and hence overcome the radiation damage effects that may limit the lifetime of solid fuels such as TRISO-containing pebbles. This molten salt is pumped through the LIFE blanket, out to a heat exchanger and back into the blanket. To mitigate corrosion, steel structures in contact with the molten salt would be plated with tungsten or nickel. The salt will be processed during operation to remove certain fission products (volatile and noble and semi-noble fission products), impurities and corrosion products. In this way neutron absorbers (fission products) are removed and neutronics performance of the molten salt is somewhat better than that of the TRISO fuel case owing to the reduced parasitic absorption. In addition, the production of Pu and rare-earth elements (REE) causes these elements to build up in the salt, and leads to a requirement for a process to remove the REE during operation to insure that the solubility of a mixed (Pu,REE)F3 solid solution is not exceeded anywhere in the molten salt system. Removal of the REE will further enhance the neutronics performance. With molten salt fuels, the plant would need to be safeguarded because materials of interest for weapons are produced and could potentially be removed.

Chemical stability of salt cake in the presence of organic materials

International Nuclear Information System (INIS)

Beitel, G.A.

1976-04-01

High-level waste stored as salt cake is principally NaNO 3 . Some organic material is known to have been added to the waste tanks. It has been suggested that some of this organic material may have become nitrated and transformed to a detonable state. Arguments are presented to discount the presence of nitrated organics in the waste tanks. Nitrated organics generated accidentally usually explode at the time of formation. Detonation tests show that salt cake and ''worst-case'' organic mixtures are not detonable. Organic mixtures with salt cake are compared with black powder, a related exothermic reactant. Black-powder mixtures of widely varying composition can and do burn explosively; ignition temperatures are 300-450 0 C. However, black-powder-type mixes cannot be ignited by radiation and are shock-insensitive. Temperatures generated by radionuclide decay in the salt are below 175 0 C and would be incapable of igniting any of these mixtures. The expected effect of radiation on organics in the waste tanks is a slow dehydrogenation and depolymerization along with a slight increase in sensitivity to oxidation. The greatest explosion hazard, if any exists, is a hydrogen--oxygen explosion from water radiolysis, but the hydrogen must first be generated and then trapped so that the concentration of hydrogen can rise above 4 vol percent. This is impossible in salt cake. Final confirmation of the safety against organic-related explosive reactions in the salt cake will be based upon analytical determinations of organic concentrations. 12 tables, 5 fig

Salt brickwork as long-term sealing in salt formations

International Nuclear Information System (INIS)

Walter, F.; Yaramanci, U.

1993-01-01

Radioactive wastes can be disposed of in deep salt formations. Rock salt is a suitable geologic medium because of its unique characteristics. Open boreholes, shafts and drifts are created to provide physical access to the repository. Long-term seals must be emplaced in these potential pathways to prevent radioactive release into the biosphere. The sealing materials must be mechanically and, most important, geochemically stable within the host rock. Salt bricks made from compressed salt-powder are understood to be the first choice long-term sealing material. Seals built of salt bricks will be ductile. Large sealing systems are built by combining the individual bricks with mortar. Raw materials for mortar are fine-grained halite powder and ground saliferous clay. This provides for the good adhesive strength of the mortar to the bricks and the high shear-strength of the mortar itself. To test the interaction of rock salt with an emplaced long-term seal, experiments will be carried out in situ, in the Asse salt mine in Germany. Simple borehole sealing experiments will be performed in horizontal holes and a complicated drift sealing experiment is planned, to demonstrate the technology of sealing a standard size drift or shaft inside a disturbed rock mass. Especially, the mechanical stability of the sealing system has to be demonstrated

Production of transgenic banana plants conferring tolerance to salt stress (abstract)

International Nuclear Information System (INIS)

Ismail, I.A.; Salama, M.; Hamid, A.A.; Sadiq, A.S.

2005-01-01

Production of bananas is limited in areas that have soils with excess sodium. In this study, a transformation system in banana Grand Nain cultivar was established using the apical meristem explant and plasmid pAB6 containing the herbicide-resistant gene (bar) as a selectable marker and gus reporter gene. The micro projectile bombardment transformation system using 650 psi was successfully used for introducing the studied genes in banana explants. The expression of the introduced genes was detected using leaf painting and GUS histochemical tests, respectively. The present results showed that among the selection stage, 36.5% of the bombarded explants survived on the BI3 medium supplemented with 3 mg/L bialaphos, while, 26.6% of the tested explants showed a positive reaction in the GUS assay. To detect the presence of bar and gus genes the PCR was successfully used. These results encourage the idea of possibility of banana crop improvement using in vitro technique through micro projectile bombardment. Therefore, the plasmid pNM1 that carries the bar and P5CS (delta 1 l-pyrroline-5-carboxylate synthetase for proline accumulation) genes was introduced in banana Grand Nain cultivar to produce transgenic plants expressing the salt tolerance gene. Results showed that the majority of herbicide-resistant banana plaptlets were successfully acclimatized. In studying the effects of different salt concentrations on the produced transgenic banana plants, results showed lower decrease in the percentage of survived plants, pseudostem diameter and leaf area with an increase of salt concentrations in case of transgenic plants compared with the controls. (author)

Parameters of Models of Structural Transformations in Alloy Steel Under Welding Thermal Cycle